data_2rq5_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 2rq5 _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 619' ' ' TRP . . . . . 0.472 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.462 0.141 0 CA-C-O 120.56 0.219 . . . . 0.0 111.366 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 122.11 163.76 12.0 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.507 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -67.61 -40.76 9.59 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.597 2.198 . . . . 0.0 112.26 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 -62.27 -36.42 82.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.854 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 623' ' ' VAL . . . . . 0.472 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 43.0 t -75.77 -39.63 38.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.817 179.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 3.8 tm0? -64.76 -40.53 95.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.669 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.24 -49.97 65.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.736 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 7.1 tt -63.48 -32.13 73.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.914 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -71.49 -50.16 34.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.317 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.21 -46.46 82.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.157 -179.727 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 30.3 mt -64.24 -40.85 90.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.056 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 7.4 ttpt -62.82 -47.24 84.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.999 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 1.3 tttm -59.1 -40.47 85.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.258 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 632' ' ' HIS . . . . . 0.474 ' CE1' HD11 ' A' ' 709' ' ' LEU . 82.6 t60 -72.78 -42.1 64.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.085 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . 0.417 HD21 ' CE2' ' A' ' 702' ' ' TYR . 20.2 mt -55.96 -49.85 72.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.355 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 634' ' ' ARG . . . . . 0.406 ' HA ' ' O ' ' A' ' 638' ' ' ILE . 1.0 OUTLIER -68.34 -39.48 81.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.847 179.988 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 1.3 m -73.68 -11.58 60.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.353 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -100.32 -4.62 28.83 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 111.733 0.271 . . . . 0.0 111.733 -179.658 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 113.23 -0.44 25.27 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.493 -0.86 . . . . 0.0 112.593 179.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 638' ' ' ILE . . . . . 0.406 ' O ' ' HA ' ' A' ' 634' ' ' ARG . 13.7 mt -108.63 104.68 17.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-O 120.666 0.27 . . . . 0.0 111.202 -179.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 1.6 m -77.42 116.8 18.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.876 0.369 . . . . 0.0 110.94 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 2.1 ttp -130.49 30.7 4.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.838 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -66.81 -39.31 87.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.01 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -63.57 -79.9 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.935 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -178.37 132.34 0.3 Allowed Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.803 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.23 142.76 27.57 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.488 2.125 . . . . 0.0 112.266 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 4.8 tp -133.84 151.93 51.7 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.211 0.529 . . . . 0.0 111.211 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 646' ' ' ILE . . . . . 0.417 ' CG2' ' HB3' ' A' ' 651' ' ' LEU . 1.1 tt -149.8 133.89 8.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.905 179.107 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.41 38.55 57.8 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.363 -0.922 . . . . 0.0 112.097 -179.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.2 7.88 64.17 Favored Glycine 0 CA--C 1.52 0.385 0 C-N-CA 120.94 -0.648 . . . . 0.0 113.584 179.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -132.67 162.55 31.1 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 117.311 0.556 . . . . 0.0 111.4 -179.307 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.78 145.21 36.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.793 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 651' ' ' LEU . . . . . 0.417 ' HB3' ' CG2' ' A' ' 646' ' ' ILE . 0.0 OUTLIER -135.22 145.37 47.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.373 -179.695 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -99.89 113.33 25.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.944 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -52.37 -39.44 60.79 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.127 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -63.69 -43.88 95.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.03 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 10.6 t -70.07 -38.31 75.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.746 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 656' ' ' PHE . . . . . 0.42 ' CE1' ' HG ' ' A' ' 682' ' ' LEU . 0.1 OUTLIER -68.7 -46.3 69.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.794 179.943 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 43.9 t80 -57.46 -48.79 78.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.893 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -60.66 -40.73 93.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.955 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.95 -51.67 68.69 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.163 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 660' ' ' ILE . . . . . 0.445 ' CG2' ' HA ' ' A' ' 666' ' ' MET . 33.3 mt -56.75 -46.14 83.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 120.821 0.343 . . . . 0.0 111.127 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 23.6 t30 -61.43 -39.82 92.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.078 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -68.26 -13.85 62.56 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.51 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.46 36.61 1.24 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.797 0.332 . . . . 0.0 111.099 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 67.92 25.88 74.12 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.644 -0.788 . . . . 0.0 112.424 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 96.4 170.07 34.57 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.541 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 666' ' ' MET . . . . . 0.475 ' HE3' ' CE1' ' A' ' 699' ' ' TYR . 10.0 tpt -65.6 -37.74 87.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.727 0.298 . . . . 0.0 111.217 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 667' ' ' GLN . . . . . 0.432 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 4.9 pt20 -50.62 -43.69 56.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.449 -179.665 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 668' ' ' GLN . . . . . 0.413 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -66.96 -52.59 40.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.815 0.341 . . . . 0.0 110.973 -179.9 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 55.4 t -49.19 -54.65 5.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.461 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 670' ' ' THR . . . . . . . . . . . . . 14.0 t -76.15 -52.51 9.94 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -178.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 671' ' ' ASP . . . . . 0.432 ' CB ' ' O ' ' A' ' 667' ' ' GLN . 19.0 t70 -59.45 -51.15 71.12 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -177.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 672' ' ' LEU . . . . . 0.413 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 4.5 mm? -76.42 0.87 18.08 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 3.1 mtpm? 49.71 81.77 0.06 Allowed 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.017 0.437 . . . . 0.0 110.363 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 3.9 mttm -144.48 20.18 1.7 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.193 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 675' ' ' TRP . . . . . 0.718 ' HB3' HD22 ' A' ' 695' ' ' LEU . 26.0 m95 -55.75 -29.85 60.25 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.324 0.583 . . . . 0.0 110.236 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 -55.88 -41.7 74.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.843 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.69 -51.76 10.07 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.173 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.699 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -58.09 -40.51 81.32 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 179.691 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 679' ' ' ALA . . . . . . . . . . . . . . . -70.27 -36.13 74.22 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.554 179.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -53.36 -48.42 68.57 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.403 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 31.6 mtm -64.08 -23.07 67.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.844 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 682' ' ' LEU . . . . . 0.42 ' HG ' ' CE1' ' A' ' 656' ' ' PHE . 3.4 mm? -78.21 -3.12 41.07 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.472 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 3.4 mtp85 70.4 71.74 0.21 Allowed 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.915 0.388 . . . . 0.0 111.592 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 2.2 mp -123.66 141.37 36.39 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.223 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -69.07 120.94 7.77 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.543 2.162 . . . . 0.0 112.752 -179.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.01 -21.59 63.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.103 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.46 -22.33 66.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.601 -179.414 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 688' ' ' ALA . . . . . 0.516 ' O ' ' HG2' ' A' ' 691' ' ' ARG . . . -72.24 116.24 12.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.929 0.395 . . . . 0.0 111.218 -179.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -83.44 4.9 25.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.396 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -121.88 -15.18 7.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.087 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 691' ' ' ARG . . . . . 0.516 ' HG2' ' O ' ' A' ' 688' ' ' ALA . 0.5 OUTLIER -55.84 -32.8 63.92 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.088 -179.639 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -70.58 -54.12 13.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.462 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.23 -37.66 72.0 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.417 -179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 2.8 mmmt -64.28 -38.63 91.73 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.089 0.471 . . . . 0.0 109.896 179.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . 0.718 HD22 ' HB3' ' A' ' 675' ' ' TRP . 4.3 tp -64.9 -47.12 78.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.812 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -55.21 -49.01 73.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.206 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -76.02 -29.65 58.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.206 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 698' ' ' ALA . . . . . 0.406 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.26 -36.83 82.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.879 -179.585 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 699' ' ' TYR . . . . . 0.475 ' CE1' ' HE3' ' A' ' 666' ' ' MET . 1.5 p90 -85.63 -36.31 20.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.973 0.416 . . . . 0.0 110.495 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 700' ' ' CYS . . . . . . . . . . . . . 5.6 t -62.95 -30.59 71.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.538 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -96.77 -5.32 38.8 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.453 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 702' ' ' TYR . . . . . 0.417 ' CE2' HD21 ' A' ' 633' ' ' LEU . 6.1 m-85 -119.11 -78.21 0.58 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.851 0.358 . . . . 0.0 111.254 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -55.34 -42.62 74.07 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.47 -179.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . 0.419 HD22 ' CE1' ' A' ' 699' ' ' TYR . 1.1 mm? -61.64 -56.03 24.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.144 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.65 -55.27 31.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.961 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 706' ' ' TYR . . . . . 0.412 ' CD2' HD13 ' A' ' 709' ' ' LEU . 53.1 t80 -59.59 -51.11 71.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.017 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -58.8 -20.57 51.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.282 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 1.4 m -84.29 -16.3 43.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.974 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 709' ' ' LEU . . . . . 0.496 ' HB3' ' HB2' ' A' ' 713' ' ' GLU . 62.3 mt -50.63 141.37 12.77 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.501 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 710' ' ' SER . . . . . 0.449 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.6 OUTLIER -75.92 168.25 29.5 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.597 179.742 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . 0.449 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 10.7 Cg_endo -54.13 -25.88 39.42 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.53 2.154 . . . . 0.0 112.376 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -69.98 -53.97 15.37 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.019 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 713' ' ' GLU . . . . . 0.496 ' HB2' ' HB3' ' A' ' 709' ' ' LEU . 62.1 mm-40 -59.73 -26.22 65.46 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.907 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 8.1 m-70 -75.89 -54.16 7.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.355 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.28 -41.77 99.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.344 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 2.8 mmm-85 -65.49 -54.2 31.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.858 0.361 . . . . 0.0 111.29 -179.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 55.0 mt -65.44 -40.63 93.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.015 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -67.99 -54.32 19.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.639 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.98 -34.55 56.52 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.465 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 720' ' ' GLU . . . . . 0.403 ' O ' ' HG2' ' A' ' 723' ' ' MET . 0.4 OUTLIER -67.51 -55.9 11.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.021 0.438 . . . . 0.0 110.494 179.832 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 33.3 t -64.06 -52.92 50.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.156 -179.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 5.1 mp -49.03 -44.8 41.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.918 -179.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 723' ' ' MET . . . . . 0.403 ' HG2' ' O ' ' A' ' 720' ' ' GLU . 18.8 ptp -72.19 -40.04 68.19 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.239 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -52.64 -34.84 53.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.436 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 725' ' ' LYS . . . . . 0.451 ' CD ' ' CE2' ' A' ' 619' ' ' TRP . 4.4 pttm -86.09 -40.29 15.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.455 -179.645 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -66.14 -52.59 46.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.383 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 727' ' ' ILE . . . . . 0.42 ' CG2' ' O ' ' A' ' 727' ' ' ILE . 4.6 mp -87.09 11.55 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.679 -179.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 4.9 tt -57.86 -32.57 67.78 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.881 0.372 . . . . 0.0 110.925 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -65.63 -68.8 0.34 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.927 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.874 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 619' ' ' TRP . . . . . 0.442 ' CE2' ' CD ' ' A' ' 725' ' ' LYS . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.145 0 CA-C-O 120.53 0.205 . . . . 0.0 111.369 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 119.78 159.04 10.79 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.47 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -66.99 -40.9 10.9 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.578 2.186 . . . . 0.0 112.013 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 19.6 m-80 -64.61 -34.91 79.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.72 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 623' ' ' VAL . . . . . 0.411 HG13 ' CG ' ' A' ' 619' ' ' TRP . 38.6 t -72.98 -39.98 58.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.89 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 3.1 tm0? -60.63 -41.18 94.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.709 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 6.6 mpt_? -67.0 -50.83 60.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.824 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 8.3 tt -62.01 -29.97 70.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.041 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -70.98 -45.07 64.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.434 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -65.13 -38.85 91.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.262 -179.668 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 38.8 mt -66.8 -46.32 85.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.497 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 630' ' ' LYS . . . . . 0.453 ' HG3' ' N ' ' A' ' 631' ' ' LYS . 19.2 pttt -66.09 -32.6 74.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.798 0.332 . . . . 0.0 110.996 -179.819 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 631' ' ' LYS . . . . . 0.453 ' N ' ' HG3' ' A' ' 630' ' ' LYS . 0.0 OUTLIER -66.39 -44.76 82.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.991 0.424 . . . . 0.0 110.735 179.838 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 632' ' ' HIS . . . . . 0.46 ' CD2' HD12 ' A' ' 709' ' ' LEU . 86.2 t60 -71.3 -38.8 71.76 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.673 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . 0.422 HD13 ' CD2' ' A' ' 702' ' ' TYR . 47.6 mt -58.33 -49.8 75.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.016 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 634' ' ' ARG . . . . . 0.442 ' HG3' ' N ' ' A' ' 635' ' ' SER . 3.6 ptp180 -64.74 -40.32 95.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.866 0.365 . . . . 0.0 110.474 179.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 635' ' ' SER . . . . . 0.442 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 0.5 OUTLIER -73.86 -11.63 60.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.946 179.262 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 33.4 mm-40 -98.6 -7.12 28.66 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.564 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 114.05 -1.05 24.17 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.584 -0.817 . . . . 0.0 112.497 179.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 638' ' ' ILE . . . . . . . . . . . . . 12.7 mt -108.11 104.77 17.61 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-O 120.635 0.255 . . . . 0.0 111.341 -179.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.6 121.19 21.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.825 0.345 . . . . 0.0 111.02 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 1.9 ttp -133.56 28.74 3.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.87 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -69.22 -30.71 68.94 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.913 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -71.61 -78.21 0.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.817 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 2.5 pp -179.93 128.37 0.24 Allowed Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.827 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -73.75 132.72 17.57 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.397 2.065 . . . . 0.0 112.289 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 4.9 tp -123.67 151.73 42.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.192 0.52 . . . . 0.0 111.276 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 646' ' ' ILE . . . . . 0.42 ' CG2' ' HB3' ' A' ' 651' ' ' LEU . 0.7 OUTLIER -149.68 133.41 8.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.979 179.108 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 54.93 37.7 63.18 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.365 -0.922 . . . . 0.0 112.228 -179.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.89 7.66 66.64 Favored Glycine 0 C--N 1.332 0.335 0 C-N-CA 120.942 -0.647 . . . . 0.0 113.563 179.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.9 m -134.36 164.38 27.56 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 117.35 0.575 . . . . 0.0 111.417 -179.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.69 145.67 36.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.757 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 651' ' ' LEU . . . . . 0.42 ' HB3' ' CG2' ' A' ' 646' ' ' ILE . 0.0 OUTLIER -134.93 145.15 47.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.384 -179.71 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -98.3 111.93 24.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.888 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -52.16 -35.74 49.53 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.056 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -68.61 -44.93 73.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.115 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 10.7 t -67.99 -36.73 80.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.656 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 656' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -68.46 -44.47 74.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.826 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 56.6 t80 -58.69 -48.73 80.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.904 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 1.4 ttm180 -59.31 -43.03 92.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.99 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.22 -49.71 73.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.145 -179.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 660' ' ' ILE . . . . . 0.437 ' CG2' ' HA ' ' A' ' 666' ' ' MET . 16.9 mt -57.43 -44.71 85.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.821 0.343 . . . . 0.0 110.786 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -65.31 -47.52 76.28 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.271 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -55.5 -20.44 12.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.747 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.82 19.6 3.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.517 0.199 . . . . 0.0 111.508 -179.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 90.84 -18.19 51.73 Favored Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.562 -0.827 . . . . 0.0 112.725 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 147.37 175.34 20.12 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.369 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 666' ' ' MET . . . . . 0.497 ' HE1' ' CZ ' ' A' ' 699' ' ' TYR . 0.0 OUTLIER -72.04 -36.69 69.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.898 0.38 . . . . 0.0 111.067 -179.928 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 667' ' ' GLN . . . . . 0.405 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 3.9 pt20 -56.08 -42.78 77.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.255 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 668' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.07 -45.14 86.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.956 0.408 . . . . 0.0 110.82 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 57.7 t -57.64 -55.71 19.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.564 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 670' ' ' THR . . . . . . . . . . . . . 9.7 t -76.04 -54.18 7.24 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.219 0.822 . . . . 0.0 113.219 -178.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 671' ' ' ASP . . . . . 0.405 ' CB ' ' O ' ' A' ' 667' ' ' GLN . 7.1 t0 -56.21 -51.11 69.26 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -178.328 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 28.0 mt -75.0 -1.81 24.36 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -179.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 11.3 mttp 50.46 84.15 0.04 OUTLIER 'General case' 0 CA--C 1.521 -0.151 0 CA-C-O 121.098 0.475 . . . . 0.0 110.371 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 5.6 tptm -148.73 21.63 1.01 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.138 -179.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 675' ' ' TRP . . . . . 0.733 ' HB3' HD23 ' A' ' 695' ' ' LEU . 27.5 m95 -56.26 -29.8 61.58 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 121.469 0.652 . . . . 0.0 109.996 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -56.45 -41.5 76.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.633 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.39 -51.75 10.29 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -179.309 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.728 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -57.32 -39.81 76.6 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.747 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 679' ' ' ALA . . . . . 0.4 ' N ' ' CD2' ' A' ' 678' ' ' LEU . . . -71.56 -34.64 70.16 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.45 179.053 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -53.59 -47.78 69.82 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.267 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.89 -21.55 66.46 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.779 179.306 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 682' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -78.28 -2.85 39.94 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.46 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 71.66 71.79 0.17 Allowed 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.928 0.394 . . . . 0.0 111.251 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 2.1 mp -124.67 135.57 26.81 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.368 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -64.92 124.58 13.31 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.563 2.176 . . . . 0.0 112.506 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.79 -17.27 63.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.294 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.42 -24.0 67.09 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.702 0.287 . . . . 0.0 111.237 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -79.31 112.28 16.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.921 0.391 . . . . 0.0 110.873 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -72.39 -68.35 0.48 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.329 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.44 -12.9 0.78 Allowed 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -179.153 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 691' ' ' ARG . . . . . . . . . . . . . 43.5 ptt85 -47.95 -42.79 28.41 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 120.919 0.39 . . . . 0.0 111.076 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -60.99 -46.95 88.67 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.041 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.28 -39.0 68.67 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.886 0.375 . . . . 0.0 111.242 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 2.4 mttm -64.45 -38.73 92.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.246 179.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . 0.733 HD23 ' HB3' ' A' ' 675' ' ' TRP . 0.9 OUTLIER -67.09 -44.23 80.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.488 179.756 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . 0.43 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 4.2 mm-40 -55.43 -48.03 75.06 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.011 0.434 . . . . 0.0 110.816 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -76.82 -29.45 55.96 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.01 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 698' ' ' ALA . . . . . 0.433 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.35 -37.87 83.93 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.675 -179.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 699' ' ' TYR . . . . . 0.497 ' CZ ' ' HE1' ' A' ' 666' ' ' MET . 1.3 p90 -84.34 -35.08 23.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.892 0.377 . . . . 0.0 110.691 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 700' ' ' CYS . . . . . . . . . . . . . 28.8 t -64.86 -30.54 71.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.956 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -98.56 -2.41 38.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.581 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 702' ' ' TYR . . . . . 0.433 ' CD1' ' O ' ' A' ' 698' ' ' ALA . 4.8 m-85 -118.44 -78.83 0.59 Allowed 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.85 0.357 . . . . 0.0 111.343 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 90.9 mt -59.82 -40.86 89.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.636 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . 0.41 HD21 ' CD1' ' A' ' 699' ' ' TYR . 0.8 OUTLIER -58.23 -55.34 36.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.92 0.39 . . . . 0.0 111.252 -179.682 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.57 -54.94 34.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.046 -179.656 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 706' ' ' TYR . . . . . 0.431 ' CD1' HD11 ' A' ' 709' ' ' LEU . 77.0 t80 -58.4 -50.32 74.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.206 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.78 -27.12 64.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.28 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 18.0 p -79.45 -16.88 55.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.178 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 709' ' ' LEU . . . . . 0.46 HD12 ' CD2' ' A' ' 632' ' ' HIS . 63.1 mt -53.37 147.34 10.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.935 0.398 . . . . 0.0 111.484 -179.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 710' ' ' SER . . . . . 0.446 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.4 OUTLIER -76.32 169.03 22.88 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.476 179.492 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . 0.446 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 15.9 Cg_endo -57.48 -21.61 46.58 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.473 2.115 . . . . 0.0 112.531 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -70.53 -53.6 15.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.056 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 713' ' ' GLU . . . . . 0.452 ' HB2' ' HB3' ' A' ' 709' ' ' LEU . 5.3 mm-40 -59.17 -26.05 64.44 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.521 -0.308 . . . . 0.0 111.125 -179.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 11.6 m-70 -75.91 -54.25 7.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.038 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 715' ' ' ARG . . . . . 0.409 ' O ' ' CG ' ' A' ' 719' ' ' LYS . 0.0 OUTLIER -64.1 -32.88 74.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.654 -179.243 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 7.9 mtt-85 -77.15 -54.22 6.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.926 0.393 . . . . 0.0 111.209 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 63.8 mt -62.74 -40.29 96.78 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.802 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -65.24 -54.59 27.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.637 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 719' ' ' LYS . . . . . 0.409 ' CG ' ' O ' ' A' ' 715' ' ' ARG . 0.7 OUTLIER -51.07 -36.76 41.76 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.425 -179.622 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 720' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -67.36 -55.78 12.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.977 0.418 . . . . 0.0 110.653 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 39.5 t -61.92 -54.16 38.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.076 -179.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 4.6 mp -48.95 -45.67 42.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.858 -179.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 723' ' ' MET . . . . . . . . . . . . . 15.7 ptp -73.11 -42.0 63.41 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 120.464 -0.495 . . . . 0.0 109.859 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -54.23 -31.24 52.83 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.31 -179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 725' ' ' LYS . . . . . 0.442 ' CD ' ' CE2' ' A' ' 619' ' ' TRP . 3.5 pttm -86.16 -36.61 19.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.335 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 726' ' ' GLU . . . . . 0.42 ' N ' ' HG3' ' A' ' 725' ' ' LYS . 4.9 mt-10 -71.65 -52.86 15.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.911 0.386 . . . . 0.0 111.124 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 727' ' ' ILE . . . . . . . . . . . . . 3.7 mp -87.63 11.66 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.68 -179.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.73 -48.96 79.39 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.745 0.307 . . . . 0.0 111.101 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -57.34 -32.46 66.75 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.1 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.197 -0.906 . . . . 0.0 110.884 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 619' ' ' TRP . . . . . 0.454 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.1 OUTLIER . . . . . 0 CA--C 1.528 0.131 0 CA-C-O 120.556 0.217 . . . . 0.0 111.565 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 122.42 157.9 10.09 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.42 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -68.84 -36.21 14.07 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.549 2.166 . . . . 0.0 112.025 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 54.9 m-80 -71.87 -30.91 65.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.696 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 623' ' ' VAL . . . . . 0.454 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 38.5 t -75.76 -37.49 35.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.617 179.583 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 2.6 tm0? -66.39 -43.49 85.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.578 179.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 6.3 mmt85 -63.43 -50.45 69.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.567 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 2.8 tt -61.06 -35.17 76.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.74 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -72.22 -46.06 57.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.204 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -58.39 -46.81 85.65 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.094 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 31.2 mt -66.75 -37.71 80.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.09 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.11 -48.46 81.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.883 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -63.47 -40.5 97.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.009 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 632' ' ' HIS . . . . . 0.451 ' CE1' ' CD1' ' A' ' 709' ' ' LEU . 67.8 t60 -66.51 -43.78 84.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.829 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . 0.426 HD11 ' CD2' ' A' ' 702' ' ' TYR . 49.7 mt -56.38 -49.92 73.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.175 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 634' ' ' ARG . . . . . 0.428 ' HG3' ' N ' ' A' ' 635' ' ' SER . 0.9 OUTLIER -60.82 -40.64 93.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.813 0.339 . . . . 0.0 110.717 179.914 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 635' ' ' SER . . . . . 0.428 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 49.1 m -73.74 -19.52 60.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.024 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -90.08 -10.46 44.65 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.586 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 119.07 -7.04 12.97 Favored Glycine 0 C--N 1.331 0.298 0 C-N-CA 120.613 -0.804 . . . . 0.0 112.524 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 638' ' ' ILE . . . . . 0.428 HG23 ' CZ ' ' A' ' 702' ' ' TYR . 3.6 mp -101.18 104.62 16.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.669 0.271 . . . . 0.0 111.143 -179.662 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 1.6 m -78.34 108.14 11.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.895 0.379 . . . . 0.0 110.869 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 1.9 mtp -122.33 28.61 7.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.98 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -61.0 -31.38 70.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.853 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 51.8 mm-40 -72.39 -78.23 0.09 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.865 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 1.1 pp -177.37 138.54 0.42 Allowed Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.888 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.65 136.92 19.71 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.562 2.175 . . . . 0.0 112.379 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 4.6 tp -133.75 150.95 51.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.245 0.545 . . . . 0.0 111.267 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 646' ' ' ILE . . . . . . . . . . . . . 1.4 tt -149.82 133.93 8.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.702 178.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.15 39.95 58.77 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.319 -0.943 . . . . 0.0 112.429 -179.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.03 7.14 61.86 Favored Glycine 0 C--N 1.333 0.381 0 C-N-CA 120.904 -0.665 . . . . 0.0 113.799 179.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -133.57 164.26 27.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 117.396 0.598 . . . . 0.0 111.374 -179.403 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -79.33 144.35 34.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.748 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 651' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -134.59 144.99 48.25 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.306 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -94.81 105.09 17.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.932 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 5.6 mp -53.88 -38.69 65.02 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.975 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -63.57 -43.16 97.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.982 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 1.7 t -69.82 -31.66 69.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.465 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 656' ' ' PHE . . . . . 0.441 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.1 OUTLIER -72.42 -44.66 62.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.827 179.789 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -59.75 -48.47 81.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.843 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.75 -43.3 99.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.112 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.57 -49.38 78.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.404 -179.648 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 660' ' ' ILE . . . . . 0.465 ' CG2' ' HA ' ' A' ' 666' ' ' MET . 85.6 mt -56.75 -45.64 82.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.793 0.33 . . . . 0.0 110.993 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.76 -44.23 86.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.109 -179.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -64.16 -32.47 74.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.159 -179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 1.2 mtm -72.73 -9.6 58.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.479 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 119.27 38.38 0.74 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.339 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 75.93 173.16 34.54 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.718 -0.754 . . . . 0.0 112.428 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 666' ' ' MET . . . . . 0.484 ' HE2' ' CZ ' ' A' ' 699' ' ' TYR . 10.5 tpt -66.45 -41.67 88.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.682 0.277 . . . . 0.0 111.366 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 667' ' ' GLN . . . . . 0.439 ' O ' ' HB2' ' A' ' 671' ' ' ASP . 5.6 pt20 -50.37 -46.66 56.1 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -179.157 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 668' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -50.78 69.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.887 0.375 . . . . 0.0 111.059 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 48.9 t -55.74 -55.5 17.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.911 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 670' ' ' THR . . . . . . . . . . . . . 15.2 t -75.95 -52.45 10.25 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -178.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 671' ' ' ASP . . . . . 0.439 ' HB2' ' O ' ' A' ' 667' ' ' GLN . 0.8 OUTLIER -60.79 -50.97 71.33 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -178.203 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 26.3 mt -76.39 1.61 15.84 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 2.3 mttm 49.86 82.96 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.021 0.439 . . . . 0.0 110.266 -179.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 1.4 ttmp? -142.73 23.73 1.91 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.304 -179.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 675' ' ' TRP . . . . . 0.764 ' CE3' HD22 ' A' ' 678' ' ' LEU . 37.8 m95 -62.4 -27.64 69.23 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.337 0.589 . . . . 0.0 110.211 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -57.67 -45.48 85.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.482 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.01 -51.61 13.17 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.742 0.306 . . . . 0.0 111.445 -179.382 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.764 HD22 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -56.01 -40.55 73.55 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 179.624 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 679' ' ' ALA . . . . . 0.413 ' N ' ' CD2' ' A' ' 678' ' ' LEU . . . -71.71 -31.87 67.2 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.496 179.18 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.18 -49.69 71.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.194 179.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 1.9 ttm -62.38 -21.44 65.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.603 179.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 682' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -80.55 -1.51 42.28 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.371 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 10.3 mmm180 68.84 71.77 0.28 Allowed 'General case' 0 N--CA 1.462 0.126 0 CA-C-O 120.936 0.398 . . . . 0.0 110.861 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.7 mp -118.78 136.48 24.23 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.926 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.52 123.68 11.43 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.486 2.124 . . . . 0.0 112.272 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -16.85 63.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.387 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.29 -23.79 67.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.01 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 688' ' ' ALA . . . . . 0.435 ' CB ' ' HB2' ' A' ' 691' ' ' ARG . . . -84.51 106.08 15.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.846 0.355 . . . . 0.0 110.95 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -73.17 -68.56 0.48 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.325 -179.576 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -51.97 -19.76 2.0 Allowed 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -179.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 691' ' ' ARG . . . . . 0.435 ' HB2' ' CB ' ' A' ' 688' ' ' ALA . 0.0 OUTLIER -46.2 -39.43 9.74 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.789 0.328 . . . . 0.0 111.223 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -58.61 -45.35 89.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.844 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.11 -37.51 69.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.99 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.8 -40.85 97.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.224 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . 0.743 HD21 ' HB3' ' A' ' 675' ' ' TRP . 0.3 OUTLIER -65.44 -44.31 87.71 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.18 179.499 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . 0.431 ' O ' ' CD2' ' A' ' 699' ' ' TYR . 42.9 tt0 -55.76 -45.88 77.98 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.884 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.25 -29.89 54.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.041 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 698' ' ' ALA . . . . . 0.449 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -66.42 -37.58 85.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.483 -179.757 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 699' ' ' TYR . . . . . 0.484 ' CZ ' ' HE2' ' A' ' 666' ' ' MET . 1.7 p90 -86.04 -33.92 20.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.074 0.464 . . . . 0.0 110.233 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 700' ' ' CYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 1.4 m -63.1 -30.53 71.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.867 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -100.97 -1.81 33.44 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.478 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 702' ' ' TYR . . . . . 0.449 ' CD1' ' O ' ' A' ' 698' ' ' ALA . 4.5 m-85 -117.57 -75.94 0.58 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.94 0.4 . . . . 0.0 111.4 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 20.2 mt -64.27 -41.73 96.78 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.812 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . 0.473 HD22 ' CE1' ' A' ' 699' ' ' TYR . 0.4 OUTLIER -47.92 -56.91 6.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.848 0.356 . . . . 0.0 111.431 -179.496 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 1.4 m -54.64 -46.44 73.93 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.27 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 706' ' ' TYR . . . . . 0.412 ' CZ ' ' NE2' ' A' ' 714' ' ' HIS . 67.7 t80 -63.43 -29.47 70.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.346 -179.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -96.92 -2.47 43.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.709 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 57.8 m -113.2 -21.57 10.93 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.727 0.298 . . . . 0.0 111.36 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 709' ' ' LEU . . . . . 0.451 ' CD1' ' CE1' ' A' ' 632' ' ' HIS . 0.2 OUTLIER -69.56 171.54 8.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.885 179.981 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -72.66 164.29 61.36 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.008 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.26 -29.88 54.81 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.544 2.163 . . . . 0.0 111.959 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -51.07 -50.81 57.97 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.75 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 713' ' ' GLU . . . . . 0.435 ' HB2' ' CD1' ' A' ' 709' ' ' LEU . 1.6 mm-40 -58.26 -28.21 64.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.935 179.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 714' ' ' HIS . . . . . 0.412 ' NE2' ' CZ ' ' A' ' 706' ' ' TYR . 1.7 m170 -76.02 -54.01 7.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.583 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.68 -44.64 96.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.37 -179.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 2.0 mtp-105 -65.66 -54.16 31.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.273 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 76.8 mt -62.98 -41.13 99.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.787 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -66.82 -54.12 25.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.3 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.74 -34.62 27.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.347 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 720' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -68.54 -55.63 11.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.009 0.433 . . . . 0.0 110.428 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 44.7 t -61.55 -53.66 45.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.808 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 3.6 mp -48.69 -46.43 40.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.884 -179.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 723' ' ' MET . . . . . 0.404 ' HG3' ' N ' ' A' ' 724' ' ' GLU . 16.5 ptp -71.49 -41.01 69.85 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.566 -0.454 . . . . 0.0 109.873 179.399 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 724' ' ' GLU . . . . . 0.404 ' N ' ' HG3' ' A' ' 723' ' ' MET . 1.9 mm-40 -53.48 -32.8 51.79 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.403 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 725' ' ' LYS . . . . . 0.437 ' CD ' ' CE2' ' A' ' 619' ' ' TRP . 8.7 pttt -86.18 -41.92 14.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.314 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -66.23 -54.0 30.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.882 0.373 . . . . 0.0 111.147 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 727' ' ' ILE . . . . . . . . . . . . . 4.3 mp -86.94 11.51 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.746 -179.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 1.7 tt -57.65 -42.15 82.88 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.817 0.342 . . . . 0.0 111.168 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -59.62 -51.06 71.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.123 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 9.4 mtpt . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.861 -179.955 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 619' ' ' TRP . . . . . 0.455 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.131 0 CA-C-O 120.645 0.259 . . . . 0.0 111.29 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 120.57 169.14 13.84 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.489 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -68.15 -38.71 11.8 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.59 2.193 . . . . 0.0 112.174 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -62.46 -42.64 99.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.93 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 623' ' ' VAL . . . . . 0.455 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 40.5 t -72.15 -35.01 51.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.845 179.704 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 2.1 tm0? -57.7 -47.32 82.69 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.766 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.69 -43.5 75.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.796 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 6.2 tt -59.7 -36.93 77.51 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.971 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -72.77 -46.29 54.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.293 -179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.17 -46.82 82.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.054 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 23.5 mt -66.63 -40.04 85.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.122 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 6.1 ttpt -62.9 -49.41 74.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.905 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 2.7 tttm -58.13 -42.57 86.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.036 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 632' ' ' HIS . . . . . 0.453 ' CE1' HD12 ' A' ' 709' ' ' LEU . 79.9 t60 -68.27 -41.92 80.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.974 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . 0.423 HD21 ' CD2' ' A' ' 702' ' ' TYR . 39.1 mt -56.04 -47.41 77.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.21 -179.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 1.7 ptt180 -65.43 -41.75 93.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.77 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.78 -13.57 60.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.304 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 636' ' ' GLN . . . . . 0.45 ' CG ' ' CE1' ' A' ' 632' ' ' HIS . 62.4 mm-40 -96.21 -9.46 30.41 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.619 -179.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 118.89 -9.86 12.3 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.595 -0.812 . . . . 0.0 112.371 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 638' ' ' ILE . . . . . 0.419 HG22 ' CE2' ' A' ' 702' ' ' TYR . 3.5 mp -98.79 104.75 16.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.708 0.29 . . . . 0.0 111.074 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -80.61 116.08 20.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.963 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 640' ' ' MET . . . . . 0.41 ' HB3' ' HE3' ' A' ' 640' ' ' MET . 1.5 ttp -124.26 16.66 9.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.182 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.79 -31.21 62.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.839 0.352 . . . . 0.0 111.036 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -70.91 -73.67 0.17 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.786 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 1.9 pp -179.73 130.77 0.25 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.749 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.11 124.79 9.81 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.432 2.088 . . . . 0.0 112.287 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 4.8 tp -127.36 152.76 47.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.28 0.562 . . . . 0.0 111.323 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 646' ' ' ILE . . . . . 0.408 ' CG2' ' HB3' ' A' ' 651' ' ' LEU . 4.4 tt -149.65 133.42 8.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.486 178.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 50.71 43.01 46.46 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.25 -0.976 . . . . 0.0 112.212 -179.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 68.86 6.77 53.44 Favored Glycine 0 CA--C 1.52 0.39 0 C-N-CA 121.068 -0.587 . . . . 0.0 113.908 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 62.4 m -130.9 161.97 30.69 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 117.609 0.705 . . . . 0.0 111.636 -179.072 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -80.41 142.57 34.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.759 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 651' ' ' LEU . . . . . 0.425 ' O ' HD12 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -135.16 145.3 47.64 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.298 -179.742 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -96.36 111.64 23.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.787 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -51.97 -38.94 58.41 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.029 -179.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -65.04 -44.35 89.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.055 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -68.55 -33.9 74.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.862 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 656' ' ' PHE . . . . . 0.438 ' CE2' HD11 ' A' ' 682' ' ' LEU . 0.7 OUTLIER -72.88 -45.16 59.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.853 -179.96 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -61.39 -46.48 89.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.725 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.96 -45.32 95.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.816 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.62 -48.76 76.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.933 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 660' ' ' ILE . . . . . 0.434 HG12 ' CD1' ' A' ' 678' ' ' LEU . 76.9 mt -58.2 -45.48 88.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.927 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 14.4 m-20 -64.74 -46.54 81.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.231 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.38 -40.71 71.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.179 -179.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.95 -27.22 68.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.028 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 131.69 46.98 0.12 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.347 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 75.99 176.45 40.81 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.505 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 666' ' ' MET . . . . . 0.437 ' HE2' ' CE1' ' A' ' 699' ' ' TYR . 0.0 OUTLIER -73.11 -30.58 63.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.768 0.318 . . . . 0.0 111.109 -179.975 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 667' ' ' GLN . . . . . 0.423 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 4.3 pt20 -57.25 -45.77 83.67 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.641 -179.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 668' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -52.76 42.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.838 0.351 . . . . 0.0 111.336 -179.615 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 66.8 t -49.51 -54.97 5.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.572 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 670' ' ' THR . . . . . 0.407 HG21 ' O ' ' A' ' 666' ' ' MET . 12.3 t -76.18 -49.59 16.8 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 -178.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 671' ' ' ASP . . . . . 0.423 ' CB ' ' O ' ' A' ' 667' ' ' GLN . 7.9 t70 -62.95 -51.16 67.96 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -177.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 10.7 mp -79.04 3.6 16.85 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -179.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 14.7 ttmm 48.56 84.81 0.03 OUTLIER 'General case' 0 C--O 1.231 0.13 0 CA-C-O 120.971 0.415 . . . . 0.0 110.507 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt -145.06 22.9 1.54 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.24 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 675' ' ' TRP . . . . . 0.779 ' CE3' HD23 ' A' ' 678' ' ' LEU . 39.4 m95 -61.24 -28.63 69.3 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 121.397 0.617 . . . . 0.0 110.112 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 -56.9 -43.9 81.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.484 -179.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.14 -51.52 12.0 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.755 0.312 . . . . 0.0 111.44 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.779 HD23 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.59 -40.39 71.98 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 179.645 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 679' ' ' ALA . . . . . 0.42 ' N ' ' CD2' ' A' ' 678' ' ' LEU . . . -71.83 -33.61 68.62 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.513 179.074 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.33 -49.5 66.96 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.211 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 19.9 mtm -62.92 -22.62 66.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.67 179.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 682' ' ' LEU . . . . . 0.461 ' O ' ' HB2' ' A' ' 683' ' ' ARG . 3.5 mm? -79.53 -1.23 36.74 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.333 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . 0.461 ' HB2' ' O ' ' A' ' 682' ' ' LEU . 0.2 OUTLIER 69.38 71.81 0.25 Allowed 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 120.951 0.405 . . . . 0.0 111.065 -179.83 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . 0.41 HG13 ' NH2' ' A' ' 691' ' ' ARG . 1.7 mp -119.81 135.7 24.39 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.72 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . 0.405 ' HD2' HG22 ' A' ' 684' ' ' ILE . 36.7 Cg_endo -65.99 123.16 10.9 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.411 2.074 . . . . 0.0 112.375 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -16.4 63.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.167 179.853 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.46 -23.74 66.99 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.12 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 688' ' ' ALA . . . . . 0.422 ' CB ' ' HB2' ' A' ' 691' ' ' ARG . . . -85.25 105.36 15.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.834 0.349 . . . . 0.0 111.011 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 -70.32 -68.35 0.43 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.141 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -53.33 -17.8 2.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.909 -179.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 691' ' ' ARG . . . . . 0.422 ' HB2' ' CB ' ' A' ' 688' ' ' ALA . 0.0 OUTLIER -46.82 -35.25 6.08 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.905 0.383 . . . . 0.0 111.143 179.904 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -66.28 -40.74 90.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.869 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.11 -37.65 69.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.889 179.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 20.9 mmtt -64.3 -40.66 96.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.173 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . 0.744 HD22 ' HB3' ' A' ' 675' ' ' TRP . 0.8 OUTLIER -64.83 -44.55 89.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.377 179.545 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . 0.43 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 3.1 mt-30 -55.42 -46.3 76.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.815 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.08 -29.63 55.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.132 179.888 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -67.49 -38.53 84.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.581 -179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 699' ' ' TYR . . . . . 0.478 ' CD2' ' CZ2' ' A' ' 675' ' ' TRP . 1.1 p90 -85.69 -31.82 22.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.948 0.404 . . . . 0.0 110.516 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 700' ' ' CYS . . . . . 0.409 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 1.6 m -65.77 -30.61 71.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.476 179.509 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -97.11 -8.47 30.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.37 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 702' ' ' TYR . . . . . 0.423 ' CD2' HD21 ' A' ' 633' ' ' LEU . 4.0 m-85 -113.47 -78.99 0.58 Allowed 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.829 0.347 . . . . 0.0 111.367 -179.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 61.6 mt -56.17 -46.55 79.31 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.618 -179.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . 0.421 HD21 ' CE1' ' A' ' 699' ' ' TYR . 1.0 OUTLIER -53.97 -48.62 70.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.901 0.382 . . . . 0.0 110.887 -179.928 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 705' ' ' SER . . . . . 0.408 ' O ' ' CD1' ' A' ' 709' ' ' LEU . 4.4 m -54.63 -54.97 34.54 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.347 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 706' ' ' TYR . . . . . 0.497 ' CE2' ' CE1' ' A' ' 714' ' ' HIS . 18.4 t80 -46.81 -43.59 18.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.787 -179.678 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -94.49 1.61 55.73 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 29.7 t -80.56 -20.29 43.74 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 709' ' ' LEU . . . . . 0.453 HD12 ' CE1' ' A' ' 632' ' ' HIS . 0.0 OUTLIER -94.62 -174.27 3.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.824 0.345 . . . . 0.0 111.46 -179.768 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 710' ' ' SER . . . . . 0.414 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.4 OUTLIER -85.3 167.06 27.54 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.965 -179.817 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . 0.414 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 18.8 Cg_endo -58.92 -17.86 39.44 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.608 2.205 . . . . 0.0 112.765 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -60.12 -52.75 64.02 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.8 0.333 . . . . 0.0 110.889 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 713' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -64.47 -25.88 68.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.955 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 714' ' ' HIS . . . . . 0.497 ' CE1' ' CE2' ' A' ' 706' ' ' TYR . 0.1 OUTLIER -74.91 -54.63 6.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.171 179.599 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 15.5 mmm180 -65.25 -36.21 83.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.274 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 18.6 mtt180 -65.52 -54.23 31.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.822 0.344 . . . . 0.0 110.993 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 30.5 mt -62.77 -34.84 78.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.694 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -69.39 -53.9 17.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.394 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -52.34 -34.09 45.72 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.432 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 720' ' ' GLU . . . . . 0.42 ' O ' ' HG2' ' A' ' 723' ' ' MET . 1.0 OUTLIER -69.35 -55.81 9.33 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.019 0.437 . . . . 0.0 110.389 179.775 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 21.5 t -61.8 -53.13 52.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.053 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 6.9 mp -51.81 -42.49 62.54 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.009 -179.271 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 723' ' ' MET . . . . . 0.42 ' HG2' ' O ' ' A' ' 720' ' ' GLU . 14.2 ptp -71.91 -39.71 69.32 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.487 -0.485 . . . . 0.0 109.994 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 724' ' ' GLU . . . . . 0.404 ' N ' ' HG3' ' A' ' 723' ' ' MET . 1.4 mt-10 -56.29 -32.0 64.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.291 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 725' ' ' LYS . . . . . 0.431 ' HD3' ' CE2' ' A' ' 619' ' ' TRP . 7.5 pttt -86.15 -43.84 12.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.298 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -63.96 -48.43 76.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.922 0.392 . . . . 0.0 110.982 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 727' ' ' ILE . . . . . 0.412 ' CG2' ' O ' ' A' ' 727' ' ' ILE . 4.3 mp -89.46 11.57 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.526 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 1.5 tt -57.69 -34.52 69.51 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.794 0.33 . . . . 0.0 110.959 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -76.88 -53.08 8.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.953 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 3.1 mttt . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.935 179.979 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 619' ' ' TRP . . . . . 0.427 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.5 OUTLIER . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.777 0.322 . . . . 0.0 110.813 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . -55.99 170.58 2.22 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.468 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.76 -49.42 2.28 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.509 2.139 . . . . 0.0 112.09 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.61 -20.64 49.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.288 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 623' ' ' VAL . . . . . 0.427 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 28.9 t -75.7 -45.93 37.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.911 0.386 . . . . 0.0 110.472 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.08 -43.81 94.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.163 179.341 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.06 -50.86 71.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.537 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 7.4 tt -62.54 -33.27 74.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.949 0.404 . . . . 0.0 110.542 179.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -69.46 -46.83 65.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.267 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -62.28 -44.64 96.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.128 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 629' ' ' ILE . . . . . 0.459 ' HA ' ' CD2' ' A' ' 632' ' ' HIS . 14.6 mt -60.54 -45.08 97.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.99 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 13.8 ttpt -64.13 -34.32 77.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.231 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.36 -48.03 74.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.641 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 632' ' ' HIS . . . . . 0.459 ' CD2' ' HA ' ' A' ' 629' ' ' ILE . 1.1 p80 -68.53 -37.83 80.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.823 0.344 . . . . 0.0 110.558 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . 0.425 ' HG ' ' CE1' ' A' ' 632' ' ' HIS . 32.1 mt -55.73 -49.95 71.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.121 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 4.1 ptt180 -65.25 -40.99 94.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.78 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 1.4 m -73.75 -13.33 60.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.408 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.39 -6.56 33.79 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.661 -179.654 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 111.96 4.21 26.11 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.6 -0.809 . . . . 0.0 112.57 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 638' ' ' ILE . . . . . . . . . . . . . 17.7 mt -110.77 106.09 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-O 120.72 0.295 . . . . 0.0 111.238 -179.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.2 118.4 24.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.892 0.377 . . . . 0.0 110.816 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 640' ' ' MET . . . . . 0.441 ' HB3' ' HE3' ' A' ' 640' ' ' MET . 1.5 ttp -121.45 23.01 10.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.174 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -58.08 -30.61 66.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.011 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -71.23 -79.49 0.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.853 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -178.36 133.82 0.31 Allowed Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.839 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -77.79 118.24 4.44 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.582 2.188 . . . . 0.0 112.388 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 4.9 tp -118.58 152.55 35.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.226 0.536 . . . . 0.0 111.181 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 646' ' ' ILE . . . . . 0.416 ' CG2' ' HB3' ' A' ' 651' ' ' LEU . 15.8 tt -149.67 133.88 8.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.828 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 52.28 40.24 52.59 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.363 -0.922 . . . . 0.0 112.239 -179.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.33 8.0 61.49 Favored Glycine 0 C--N 1.333 0.382 0 C-N-CA 120.913 -0.66 . . . . 0.0 113.686 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.2 m -133.51 163.3 29.68 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 117.366 0.583 . . . . 0.0 111.368 -179.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -79.84 144.67 33.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.657 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 651' ' ' LEU . . . . . 0.416 ' HB3' ' CG2' ' A' ' 646' ' ' ILE . 0.0 OUTLIER -134.62 145.07 48.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.352 -179.783 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -97.08 109.76 22.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.841 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 5.7 mp -52.14 -37.84 55.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.004 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -66.05 -44.05 85.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.174 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 5.7 t -69.9 -36.45 75.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.67 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 656' ' ' PHE . . . . . 0.42 ' CZ ' ' HG ' ' A' ' 682' ' ' LEU . 0.2 OUTLIER -70.93 -45.85 63.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.831 179.998 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -57.73 -50.57 72.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.993 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.87 -41.17 95.41 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.989 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . 0.409 ' CD2' ' CD2' ' A' ' 682' ' ' LEU . 0.1 OUTLIER -59.0 -49.85 76.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.111 -179.794 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 660' ' ' ILE . . . . . 0.456 ' CG2' ' HA ' ' A' ' 666' ' ' MET . 62.8 mt -56.87 -46.14 83.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.767 0.318 . . . . 0.0 110.882 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -61.81 -38.08 86.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.016 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 51.6 tt0 -66.69 -14.73 62.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.422 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.16 33.59 1.72 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.824 0.345 . . . . 0.0 111.101 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 72.46 25.16 74.94 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.641 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 97.48 169.61 32.93 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.583 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 666' ' ' MET . . . . . 0.495 ' HE2' ' CE1' ' A' ' 699' ' ' TYR . 9.6 tpt -64.82 -37.47 87.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.703 0.287 . . . . 0.0 111.116 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 667' ' ' GLN . . . . . 0.448 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 8.3 pt20 -50.79 -44.13 58.76 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.308 -179.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 668' ' ' GLN . . . . . 0.418 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -65.85 -52.74 47.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.903 0.382 . . . . 0.0 110.922 179.959 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 48.4 t -49.57 -55.83 4.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.687 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 670' ' ' THR . . . . . 0.401 ' CG2' ' N ' ' A' ' 671' ' ' ASP . 14.0 t -76.27 -53.67 7.9 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.658 0.984 . . . . 0.0 113.658 -178.491 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 671' ' ' ASP . . . . . 0.448 ' CB ' ' O ' ' A' ' 667' ' ' GLN . 6.3 t70 -58.56 -51.17 71.03 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -177.654 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 672' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 9.1 mp -77.22 1.84 17.27 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -178.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 49.07 83.43 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.13 0.49 . . . . 0.0 110.532 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.18 22.7 1.36 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.646 -0.707 . . . . 0.0 110.981 -179.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 675' ' ' TRP . . . . . 0.738 ' HB3' HD22 ' A' ' 695' ' ' LEU . 29.3 m95 -58.47 -28.63 65.51 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 121.391 0.615 . . . . 0.0 110.204 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 14.8 m-80 -56.11 -41.59 75.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.895 -179.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 6.3 mmtp -77.8 -51.82 9.89 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 120.703 0.287 . . . . 0.0 111.66 -179.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.697 HD23 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -58.06 -40.86 82.07 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.862 -0.421 . . . . 0.0 109.862 179.689 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 679' ' ' ALA . . . . . 0.402 ' N ' ' CD2' ' A' ' 678' ' ' LEU . . . -71.56 -33.76 69.38 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.423 179.028 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.74 -49.07 68.96 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.395 179.513 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 2.9 ttp -64.57 -22.37 66.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.906 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 682' ' ' LEU . . . . . 0.439 ' O ' ' HB2' ' A' ' 683' ' ' ARG . 3.1 mm? -78.3 -2.99 40.7 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.446 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . 0.439 ' HB2' ' O ' ' A' ' 682' ' ' LEU . 37.7 mmt180 70.02 71.8 0.23 Allowed 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.979 0.418 . . . . 0.0 111.497 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 2.0 mp -122.22 141.9 35.59 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.073 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -69.67 119.42 6.37 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.511 2.141 . . . . 0.0 112.655 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 8.3 mmmt -69.87 -21.89 63.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.095 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -65.35 -21.6 66.71 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.389 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 688' ' ' ALA . . . . . 0.48 ' O ' ' HG2' ' A' ' 691' ' ' ARG . . . -72.58 115.75 12.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.873 0.368 . . . . 0.0 111.007 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 67.0 mm-40 -83.39 5.9 21.93 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.49 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -123.81 -15.19 7.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.946 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 691' ' ' ARG . . . . . 0.48 ' HG2' ' O ' ' A' ' 688' ' ' ALA . 0.0 OUTLIER -53.42 -33.1 52.68 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-O 120.744 0.307 . . . . 0.0 110.951 -179.609 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . 0.414 HD21 ' CD ' ' A' ' 691' ' ' ARG . 3.2 mm? -70.57 -49.54 46.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.056 179.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.19 -39.65 68.46 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.501 -179.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 6.3 mtpt -64.01 -38.85 92.58 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.033 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . 0.738 HD22 ' HB3' ' A' ' 675' ' ' TRP . 4.0 tp -65.08 -47.32 77.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.827 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . 0.4 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 43.5 mt-30 -55.33 -46.8 76.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.105 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -76.95 -29.67 55.69 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.131 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 698' ' ' ALA . . . . . 0.415 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.97 -37.48 81.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.797 -179.506 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 699' ' ' TYR . . . . . 0.495 ' CE1' ' HE2' ' A' ' 666' ' ' MET . 1.2 p90 -86.6 -33.5 20.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.032 0.444 . . . . 0.0 110.442 179.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 700' ' ' CYS . . . . . 0.417 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 1.8 m -65.78 -30.46 71.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.887 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -98.53 -1.52 40.92 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.549 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 702' ' ' TYR . . . . . 0.416 ' CD2' HD23 ' A' ' 633' ' ' LEU . 7.6 m-85 -122.55 -75.94 0.59 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.791 0.329 . . . . 0.0 111.308 -179.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 19.7 mt -56.0 -44.55 78.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.439 -179.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . 0.46 HD23 ' CE1' ' A' ' 699' ' ' TYR . 0.9 OUTLIER -54.84 -27.17 40.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.15 -179.91 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 705' ' ' SER . . . . . 0.42 ' HB3' ' CE1' ' A' ' 632' ' ' HIS . 0.2 OUTLIER -67.99 -55.52 12.37 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.557 179.901 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 706' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -53.15 -46.62 68.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.147 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -74.82 -19.42 60.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.526 -179.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 40.0 t -88.99 -35.21 16.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.767 0.318 . . . . 0.0 111.21 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 709' ' ' LEU . . . . . . . . . . . . . 71.8 mt -56.67 150.06 16.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.184 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 710' ' ' SER . . . . . 0.422 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.5 OUTLIER -75.7 166.82 42.1 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.8 179.953 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . 0.422 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 11.4 Cg_endo -54.8 -26.08 45.99 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.542 2.161 . . . . 0.0 112.334 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.84 -53.35 58.43 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.747 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 713' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -60.21 -26.21 66.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.033 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 17.4 m170 -75.83 -54.38 7.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.944 0.402 . . . . 0.0 110.471 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 17.0 mtt180 -60.56 -47.62 85.4 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.461 -179.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.93 -54.17 34.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.568 -179.394 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 73.9 mt -62.38 -41.93 99.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.978 -179.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -65.95 -54.25 28.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.836 0.35 . . . . 0.0 110.2 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 1.5 mmpt? -50.42 -33.57 21.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.331 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 720' ' ' GLU . . . . . 0.402 ' O ' ' HG2' ' A' ' 723' ' ' MET . 12.7 mt-10 -69.25 -55.36 10.76 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.578 179.648 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 25.2 t -64.06 -54.99 24.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.922 -179.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . 0.421 ' O ' ' HG3' ' A' ' 725' ' ' LYS . 1.1 mp -49.16 -43.37 41.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.724 -179.524 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 723' ' ' MET . . . . . 0.402 ' HG2' ' O ' ' A' ' 720' ' ' GLU . 8.0 ptp -73.85 -40.48 63.25 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.562 -0.455 . . . . 0.0 109.942 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -51.08 -38.06 49.43 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.532 -179.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 725' ' ' LYS . . . . . 0.421 ' HG3' ' O ' ' A' ' 722' ' ' LEU . 0.0 OUTLIER -86.08 -34.78 20.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.732 0.301 . . . . 0.0 111.088 -179.787 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -65.35 -54.33 30.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.026 0.441 . . . . 0.0 110.789 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 727' ' ' ILE . . . . . . . . . . . . . 4.1 mp -88.48 11.49 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.539 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 2.7 tt -59.12 -48.0 83.2 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.833 0.349 . . . . 0.0 111.094 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -60.51 -50.05 75.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.097 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.873 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 619' ' ' TRP . . . . . 0.435 ' CG ' ' HB ' ' A' ' 623' ' ' VAL . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.736 0.303 . . . . 0.0 110.779 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . -66.3 169.48 32.35 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.452 -0.88 . . . . 0.0 111.907 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -64.15 -29.04 64.98 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.365 2.044 . . . . 0.0 111.862 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 46.4 m-80 -63.94 -38.61 91.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.932 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 623' ' ' VAL . . . . . 0.435 ' HB ' ' CG ' ' A' ' 619' ' ' TRP . 41.4 t -73.3 -36.65 49.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.116 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 3.0 tm0? -59.41 -48.09 82.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.839 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.49 -49.41 66.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.024 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 9.6 tt -62.32 -31.19 71.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.063 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -66.79 -52.16 47.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.3 -179.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 1.3 m -57.14 -53.19 60.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.124 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 18.8 mt -58.92 -39.84 78.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.054 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 4.1 tmmm? -59.81 -40.48 88.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.837 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 4.8 tttm -66.08 -40.76 91.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.001 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 632' ' ' HIS . . . . . 0.446 ' CG ' HD12 ' A' ' 709' ' ' LEU . 67.3 t60 -68.34 -44.95 74.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.031 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . 0.451 ' CD2' ' CD2' ' A' ' 702' ' ' TYR . 25.6 mt -56.53 -49.82 73.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.26 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 18.4 ptt180 -61.87 -41.72 98.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.841 0.353 . . . . 0.0 110.913 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.63 -19.49 60.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.25 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -89.1 -8.55 53.62 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.646 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 113.3 3.92 24.0 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.39 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 638' ' ' ILE . . . . . 0.421 HG21 ' CE2' ' A' ' 702' ' ' TYR . 17.2 mt -111.5 104.83 17.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-O 120.747 0.308 . . . . 0.0 111.267 -179.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -82.59 110.78 17.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.868 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 1.8 ttp -121.11 30.73 6.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.966 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.32 -29.81 71.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.873 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -71.57 -76.18 0.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.019 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -179.75 139.24 0.32 Allowed Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.846 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_endo -77.95 138.52 16.6 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.603 2.202 . . . . 0.0 112.455 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 4.8 tp -134.9 151.21 50.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.229 0.538 . . . . 0.0 111.121 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 646' ' ' ILE . . . . . 0.406 ' CG2' ' HB3' ' A' ' 651' ' ' LEU . 1.2 tt -148.96 132.55 7.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.386 -0.824 . . . . 0.0 109.533 178.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 52.26 43.18 56.97 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.3 -0.952 . . . . 0.0 112.21 -179.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 68.71 6.61 51.49 Favored Glycine 0 C--N 1.334 0.453 0 C-N-CA 121.032 -0.604 . . . . 0.0 113.91 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 87.0 m -131.51 163.07 28.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 117.507 0.654 . . . . 0.0 111.513 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -80.5 143.88 32.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.798 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 651' ' ' LEU . . . . . 0.406 ' HB3' ' CG2' ' A' ' 646' ' ' ILE . 0.0 OUTLIER -135.0 144.93 47.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.344 -179.841 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -94.02 107.99 19.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.971 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 7.2 mp -54.32 -42.89 70.67 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.997 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -61.44 -46.68 89.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.013 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 1.1 t -66.79 -35.6 80.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.743 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 656' ' ' PHE . . . . . 0.42 ' CD2' HD12 ' A' ' 682' ' ' LEU . 0.2 OUTLIER -70.68 -42.46 70.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.887 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -59.78 -52.04 67.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.039 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 16.9 ttt180 -59.97 -43.41 95.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.093 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.84 -43.32 80.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.024 -179.845 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 660' ' ' ILE . . . . . 0.431 HG12 ' CD1' ' A' ' 678' ' ' LEU . 89.4 mt -64.26 -43.61 97.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.736 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -64.17 -45.89 86.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.052 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -61.23 -21.0 63.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.178 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.81 8.77 21.4 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.503 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 98.87 25.64 9.59 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.638 -0.792 . . . . 0.0 112.644 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 92.0 174.8 42.48 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.561 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 666' ' ' MET . . . . . 0.418 ' HG2' ' CG2' ' A' ' 660' ' ' ILE . 0.0 OUTLIER -69.66 -25.69 64.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.661 0.267 . . . . 0.0 111.09 179.863 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 667' ' ' GLN . . . . . 0.404 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 15.9 pt20 -59.1 -48.51 81.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.797 -179.358 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 668' ' ' GLN . . . . . 0.418 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -64.82 -52.81 54.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.897 0.379 . . . . 0.0 111.225 -179.483 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 669' ' ' VAL . . . . . 0.42 HG11 ' CD1' ' A' ' 675' ' ' TRP . 57.5 t -49.54 -55.35 4.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.681 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 670' ' ' THR . . . . . 0.4 HG22 ' O ' ' A' ' 666' ' ' MET . 10.6 t -76.44 -48.53 19.38 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 -178.176 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 671' ' ' ASP . . . . . 0.404 ' CB ' ' O ' ' A' ' 667' ' ' GLN . 5.0 t70 -66.31 -51.08 60.93 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -177.649 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 672' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 11.1 mp -77.52 3.83 12.6 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -179.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 48.92 84.18 0.03 OUTLIER 'General case' 0 C--O 1.231 0.125 0 CA-C-O 120.936 0.398 . . . . 0.0 110.446 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 62.1 tttt -145.65 22.16 1.46 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.327 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 675' ' ' TRP . . . . . 0.769 ' CE3' HD22 ' A' ' 678' ' ' LEU . 34.9 m95 -61.13 -28.91 69.45 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 121.381 0.61 . . . . 0.0 110.125 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -56.02 -43.43 77.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.546 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.41 -51.61 11.5 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 120.687 0.28 . . . . 0.0 111.538 -179.279 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.769 HD22 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.01 -41.21 71.0 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 179.738 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 679' ' ' ALA . . . . . 0.413 ' N ' ' CD2' ' A' ' 678' ' ' LEU . . . -71.55 -34.66 70.19 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.743 179.346 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -53.23 -48.54 68.08 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.452 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 3.9 ttm -63.81 -21.56 66.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.702 179.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 682' ' ' LEU . . . . . 0.428 ' O ' ' HB2' ' A' ' 683' ' ' ARG . 2.2 mm? -80.48 -1.87 43.49 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.402 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . 0.428 ' HB2' ' O ' ' A' ' 682' ' ' LEU . 0.3 OUTLIER 71.23 71.74 0.18 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.887 0.375 . . . . 0.0 111.293 179.95 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . 0.418 HG22 ' CZ ' ' A' ' 691' ' ' ARG . 1.7 mp -120.57 137.16 25.93 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.626 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -67.51 123.91 11.38 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.47 2.113 . . . . 0.0 112.328 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -69.94 -13.7 62.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.412 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 1.5 p -65.34 -22.28 66.8 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.748 0.309 . . . . 0.0 111.253 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 688' ' ' ALA . . . . . 0.45 ' CB ' ' HB2' ' A' ' 691' ' ' ARG . . . -88.46 100.16 12.83 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.889 0.376 . . . . 0.0 110.937 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 13.1 mp0 -68.53 -67.56 0.46 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.289 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -52.81 -19.26 2.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.872 -179.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 691' ' ' ARG . . . . . 0.45 ' HB2' ' CB ' ' A' ' 688' ' ' ALA . 0.0 OUTLIER -45.39 -42.04 9.76 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.783 0.325 . . . . 0.0 111.347 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -56.58 -42.69 79.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.955 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.99 -37.18 69.9 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.79 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 1.3 ttpp -64.62 -40.23 95.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.241 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . 0.75 HD23 ' HB3' ' A' ' 675' ' ' TRP . 0.4 OUTLIER -65.13 -44.08 89.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.254 179.517 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . 0.447 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 2.0 mt-30 -55.48 -45.96 76.94 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.798 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -77.16 -29.66 54.59 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.073 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 698' ' ' ALA . . . . . 0.412 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.63 -39.03 84.66 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.599 -179.796 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 699' ' ' TYR . . . . . 0.461 ' CD2' ' CZ2' ' A' ' 675' ' ' TRP . 1.3 p90 -84.72 -32.78 23.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.88 0.371 . . . . 0.0 110.488 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 700' ' ' CYS . . . . . . . . . . . . . 32.6 t -66.03 -30.62 71.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.721 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -97.65 -2.07 42.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.329 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 702' ' ' TYR . . . . . 0.451 ' CD2' ' CD2' ' A' ' 633' ' ' LEU . 6.8 m-85 -121.61 -74.83 0.6 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.869 0.366 . . . . 0.0 111.245 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 1.7 tp -58.37 -48.4 80.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.589 -179.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . 0.433 HD21 ' CE1' ' A' ' 699' ' ' TYR . 0.6 OUTLIER -50.17 -47.62 54.38 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.861 0.362 . . . . 0.0 111.481 -179.663 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.66 -55.19 32.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.128 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 706' ' ' TYR . . . . . 0.406 ' CE2' ' CE1' ' A' ' 714' ' ' HIS . 57.9 t80 -66.78 -29.7 69.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.276 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -76.29 -18.82 58.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.43 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 36.6 p -95.87 -14.65 23.0 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.703 0.287 . . . . 0.0 111.437 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 709' ' ' LEU . . . . . 0.446 HD12 ' CG ' ' A' ' 632' ' ' HIS . 70.2 mt -56.46 151.12 13.83 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.939 0.4 . . . . 0.0 111.358 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 710' ' ' SER . . . . . 0.407 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.6 OUTLIER -78.76 169.73 19.38 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.603 179.66 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . 0.407 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 55.7 Cg_endo -70.06 -12.83 33.07 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.519 2.146 . . . . 0.0 112.851 -179.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -75.47 -56.78 4.37 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.847 0.356 . . . . 0.0 111.109 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 713' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.93 -25.41 64.56 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.689 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 714' ' ' HIS . . . . . 0.406 ' CE1' ' CE2' ' A' ' 706' ' ' TYR . 0.4 OUTLIER -70.03 -54.79 11.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.298 -0.41 . . . . 0.0 109.921 179.361 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 2.2 tpt180 -60.65 -40.31 91.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.056 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 27.6 ttp180 -65.33 -53.78 38.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.091 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 47.1 mt -60.45 -41.48 94.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.795 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -66.99 -54.15 24.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.441 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.8 -31.6 27.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.482 -179.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 720' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -72.06 -55.39 7.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.006 0.431 . . . . 0.0 110.514 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 40.2 t -62.6 -54.6 31.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.757 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . 0.4 ' O ' ' CG ' ' A' ' 725' ' ' LYS . 7.0 mp -53.6 -40.81 66.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.852 -179.389 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 723' ' ' MET . . . . . 0.41 ' HG3' ' N ' ' A' ' 724' ' ' GLU . 8.2 ptp -71.34 -39.15 71.52 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.024 179.551 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 724' ' ' GLU . . . . . 0.41 ' N ' ' HG3' ' A' ' 723' ' ' MET . 6.6 mm-40 -57.92 -31.32 66.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.119 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 725' ' ' LYS . . . . . 0.426 ' HD3' ' NE1' ' A' ' 619' ' ' TRP . 11.4 pttt -86.12 -34.45 20.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.443 -179.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 726' ' ' GLU . . . . . 0.403 ' N ' ' HG3' ' A' ' 725' ' ' LYS . 3.5 mm-40 -73.5 -47.55 40.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.282 -179.529 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 727' ' ' ILE . . . . . 0.421 ' CG2' ' O ' ' A' ' 727' ' ' ILE . 4.0 mp -88.16 11.6 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.635 -179.789 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 3.2 tt -64.41 -35.75 81.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.817 0.341 . . . . 0.0 110.837 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -58.64 -43.6 89.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.985 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 1.7 mtmt . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.858 -179.992 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 619' ' ' TRP . . . . . 0.444 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.135 0 CA-C-O 120.598 0.237 . . . . 0.0 111.387 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 124.29 165.08 12.12 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.363 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -70.6 -41.93 2.88 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.596 2.197 . . . . 0.0 112.461 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -66.75 -30.93 71.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.01 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 623' ' ' VAL . . . . . 0.444 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 55.5 t -74.96 -40.8 45.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.917 0.389 . . . . 0.0 110.442 179.391 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 35.7 tp60 -65.09 -34.59 78.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.951 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 81.6 mtm-85 -64.7 -50.72 65.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.248 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -62.02 -32.14 72.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.691 179.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -74.04 -53.92 8.96 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.744 -179.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 25.0 p -57.07 -42.38 80.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.24 -179.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 55.4 mt -68.68 -40.48 81.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.882 0.373 . . . . 0.0 110.732 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 2.5 ttpt -62.0 -46.57 88.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.718 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 5.3 tttm -65.18 -40.52 94.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.088 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 632' ' ' HIS . . . . . 0.443 ' CE1' ' CG ' ' A' ' 636' ' ' GLN . 79.3 t60 -68.85 -44.85 72.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.084 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . 0.428 HD23 ' CD2' ' A' ' 702' ' ' TYR . 35.6 mt -56.21 -49.91 72.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.308 -179.623 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -62.73 -42.29 99.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.997 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.74 -16.1 61.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.299 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 636' ' ' GLN . . . . . 0.443 ' CG ' ' CE1' ' A' ' 632' ' ' HIS . 67.8 mm-40 -92.67 -9.12 42.0 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.563 -179.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 114.41 0.33 23.52 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.374 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 638' ' ' ILE . . . . . 0.427 HG23 ' CE2' ' A' ' 702' ' ' TYR . 11.4 mt -108.16 105.41 18.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 CA-C-O 120.767 0.318 . . . . 0.0 111.254 -179.531 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.29 109.82 17.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.851 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 1.7 mtp -118.16 28.71 8.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.961 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.88 -38.15 90.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.903 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -60.96 -76.4 0.05 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.997 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -178.74 123.28 0.24 Allowed Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.761 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -63.26 139.95 74.73 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.488 2.125 . . . . 0.0 112.33 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 5.0 tp -142.01 153.2 44.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.269 0.557 . . . . 0.0 111.223 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 646' ' ' ILE . . . . . 0.413 ' CG2' ' HB3' ' A' ' 651' ' ' LEU . 3.2 tt -149.84 133.76 8.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.466 178.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 49.72 43.43 37.99 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.192 -1.004 . . . . 0.0 111.98 -179.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 68.48 6.02 46.7 Favored Glycine 0 CA--C 1.521 0.427 0 C-N-CA 121.149 -0.548 . . . . 0.0 113.972 179.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.3 m -129.58 160.89 31.87 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 117.586 0.693 . . . . 0.0 111.697 -178.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -78.9 140.62 38.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.824 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 651' ' ' LEU . . . . . 0.413 ' HB3' ' CG2' ' A' ' 646' ' ' ILE . 0.0 OUTLIER -134.63 144.92 48.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.14 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -96.86 111.65 23.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.866 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -54.62 -37.77 66.01 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.89 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -63.91 -46.0 86.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.893 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 33.8 t -66.71 -35.43 80.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.646 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 656' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -70.53 -44.58 67.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.783 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 36.2 t80 -58.01 -43.26 86.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.73 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -66.1 -43.59 86.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.692 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.68 -52.39 65.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.215 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 660' ' ' ILE . . . . . 0.436 HG12 ' CD1' ' A' ' 678' ' ' LEU . 57.1 mt -57.87 -45.19 87.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.049 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -64.61 -44.27 91.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.396 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -55.13 -22.9 18.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.412 -179.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 12.6 mtm -95.49 35.91 1.3 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.853 0.358 . . . . 0.0 110.845 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 88.23 -50.8 3.91 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.354 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 171.76 -174.73 45.23 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 121.025 -0.607 . . . . 0.0 111.914 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 666' ' ' MET . . . . . 0.504 ' HE1' ' CE2' ' A' ' 699' ' ' TYR . 11.1 tpt -73.08 -30.35 63.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.872 0.368 . . . . 0.0 110.899 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -57.65 -49.1 77.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.412 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 668' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.66 -52.7 62.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.858 0.361 . . . . 0.0 111.294 -179.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 56.4 t -49.31 -55.41 4.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.792 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 670' ' ' THR . . . . . . . . . . . . . 14.1 t -76.09 -49.64 16.87 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -178.284 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 -61.97 -51.07 69.57 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 -177.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 9.1 mp -78.93 5.2 12.14 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 48.87 83.63 0.04 OUTLIER 'General case' 0 C--O 1.231 0.122 0 CA-C-O 120.994 0.426 . . . . 0.0 110.535 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 14.8 mttm -142.46 22.98 2.0 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.188 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 675' ' ' TRP . . . . . 0.782 ' CE3' HD22 ' A' ' 678' ' ' LEU . 37.7 m95 -61.44 -27.62 68.69 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.358 0.599 . . . . 0.0 110.221 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 -57.3 -45.57 84.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.613 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.45 -51.63 12.58 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 120.703 0.287 . . . . 0.0 111.587 -179.355 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.782 HD22 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -54.9 -40.64 70.02 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 179.759 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 679' ' ' ALA . . . . . 0.431 ' N ' ' CD2' ' A' ' 678' ' ' LEU . . . -71.78 -33.9 68.99 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.602 179.312 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.22 -50.37 64.88 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.417 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 2.8 mtp -62.11 -19.88 63.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.78 179.301 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 682' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -84.71 -1.5 56.27 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.384 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 23.3 mmm-85 70.86 71.69 0.19 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.946 0.403 . . . . 0.0 111.029 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . 0.425 HG21 ' HD2' ' A' ' 685' ' ' PRO . 1.6 mp -121.1 137.47 26.71 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.654 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . 0.425 ' HD2' HG21 ' A' ' 684' ' ' ILE . 38.9 Cg_endo -67.09 121.84 9.06 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.391 2.06 . . . . 0.0 112.381 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.91 -18.95 63.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.269 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -65.37 -22.15 66.77 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.241 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 688' ' ' ALA . . . . . 0.4 ' CB ' ' HB2' ' A' ' 691' ' ' ARG . . . -84.53 105.23 15.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.977 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 20.0 mp0 -70.12 -68.61 0.41 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.164 -179.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -51.73 -20.69 2.25 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.798 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 691' ' ' ARG . . . . . 0.412 ' CZ ' HG13 ' A' ' 684' ' ' ILE . 0.0 OUTLIER -47.98 -36.4 12.59 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.865 0.364 . . . . 0.0 111.121 179.873 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -65.38 -45.72 82.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.898 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.02 -37.9 69.69 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.855 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.92 -39.64 94.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.08 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . 0.694 HD22 ' HB3' ' A' ' 675' ' ' TRP . 0.2 OUTLIER -65.95 -42.15 90.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.135 179.408 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . 0.432 ' O ' ' CD1' ' A' ' 699' ' ' TYR . 23.5 mt-30 -57.48 -44.09 84.6 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.786 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -77.31 -30.0 53.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.157 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 698' ' ' ALA . . . . . 0.424 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -66.6 -37.75 85.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.442 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 699' ' ' TYR . . . . . 0.504 ' CE2' ' HE1' ' A' ' 666' ' ' MET . 1.8 p90 -86.54 -34.91 19.81 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.108 0.48 . . . . 0.0 109.961 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 700' ' ' CYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 52.4 t -61.01 -30.59 70.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.617 179.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -99.75 -3.4 32.91 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.351 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 702' ' ' TYR . . . . . 0.428 ' CD2' HD23 ' A' ' 633' ' ' LEU . 4.8 m-85 -115.47 -77.16 0.57 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.882 0.372 . . . . 0.0 111.366 -179.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 1.9 tp -63.6 -40.63 97.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.662 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . 0.453 ' CD2' ' CE2' ' A' ' 699' ' ' TYR . 0.5 OUTLIER -54.06 -50.63 66.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.902 0.382 . . . . 0.0 111.207 -179.68 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -54.3 -54.6 38.08 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.897 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 706' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -57.78 -28.87 64.38 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.415 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -96.99 -1.82 44.79 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -106.82 -20.82 13.22 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.584 0.23 . . . . 0.0 111.602 -179.436 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 709' ' ' LEU . . . . . 0.443 ' CD1' ' HB2' ' A' ' 713' ' ' GLU . 0.2 OUTLIER -77.54 176.15 9.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.799 0.333 . . . . 0.0 110.97 -179.846 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.16 164.98 57.38 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.158 -179.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -66.68 -28.93 43.85 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.653 2.235 . . . . 0.0 112.102 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -48.86 -48.75 41.71 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.702 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 713' ' ' GLU . . . . . 0.443 ' HB2' ' CD1' ' A' ' 709' ' ' LEU . 3.5 mm-40 -61.34 -26.38 67.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.059 179.713 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -76.04 -54.28 7.09 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.989 0.423 . . . . 0.0 110.322 179.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.31 -43.27 96.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.336 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.61 -53.96 34.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.824 0.345 . . . . 0.0 111.168 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 76.2 mt -62.25 -42.12 99.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.092 -179.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -68.84 -54.21 17.01 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.47 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 6.4 mmtt -50.81 -31.85 18.26 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.106 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 720' ' ' GLU . . . . . 0.402 ' O ' ' HG2' ' A' ' 723' ' ' MET . 13.1 mt-10 -70.96 -55.5 8.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.497 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 35.4 t -63.2 -54.84 27.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.872 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -52.9 -41.11 64.08 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.942 -179.263 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 723' ' ' MET . . . . . 0.402 ' HG2' ' O ' ' A' ' 720' ' ' GLU . 15.4 ptp -73.92 -40.72 62.91 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.066 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -54.54 -40.73 68.95 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.312 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 725' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.13 -37.56 18.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.289 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.65 -57.28 8.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.875 0.369 . . . . 0.0 111.029 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 727' ' ' ILE . . . . . . . . . . . . . 4.1 mp -88.19 11.64 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.676 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 1.8 tt -52.22 -41.63 62.89 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.827 0.346 . . . . 0.0 111.159 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -76.4 -59.91 2.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.934 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 13.2 mtmt . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.236 -0.888 . . . . 0.0 110.891 -179.966 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 619' ' ' TRP . . . . . 0.444 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.123 0 CA-C-O 120.643 0.259 . . . . 0.0 111.248 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 124.41 165.24 12.14 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.484 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -68.0 -35.38 20.5 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 122.575 2.184 . . . . 0.0 112.222 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 11.0 p30 -66.65 -39.36 88.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.852 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 623' ' ' VAL . . . . . 0.444 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 41.2 t -72.95 -40.84 60.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.77 179.613 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -58.0 -41.42 83.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.641 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.03 -47.7 67.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.67 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 5.6 tt -62.22 -32.92 73.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.004 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -73.92 -50.01 22.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.273 -179.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.08 -47.14 81.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.056 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 12.1 mt -65.42 -41.22 90.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.046 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 9.4 ttpt -61.7 -50.98 70.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.797 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 7.2 tttm -56.58 -41.0 76.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.168 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 632' ' ' HIS . . . . . 0.468 ' CE1' HD12 ' A' ' 709' ' ' LEU . 80.7 t60 -70.97 -43.29 68.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.309 -179.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . 0.425 HD23 ' CD2' ' A' ' 702' ' ' TYR . 48.1 mt -56.28 -48.01 77.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.166 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 38.3 ptt180 -66.04 -41.07 91.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.813 0.34 . . . . 0.0 110.626 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.76 -11.56 60.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.184 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -98.74 -7.73 27.2 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.605 -0.271 . . . . 0.0 111.659 -179.606 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 115.52 -0.01 21.89 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.508 -0.853 . . . . 0.0 112.542 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 638' ' ' ILE . . . . . 0.425 HG23 ' CZ ' ' A' ' 702' ' ' TYR . 14.5 mt -109.4 104.71 17.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.662 0.268 . . . . 0.0 111.223 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.92 113.55 15.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.829 0.347 . . . . 0.0 110.964 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 2.0 ttp -123.73 31.49 5.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.859 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.7 -33.72 71.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.934 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -70.28 -78.33 0.07 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.893 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -177.59 132.53 0.34 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.877 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -79.67 135.3 11.47 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.531 2.154 . . . . 0.0 112.284 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 4.6 tp -129.09 152.42 48.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.237 0.542 . . . . 0.0 111.216 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 646' ' ' ILE . . . . . 0.419 ' CG2' ' HB3' ' A' ' 651' ' ' LEU . 4.2 tt -149.74 133.95 8.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.921 179.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.41 38.85 58.38 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.362 -0.923 . . . . 0.0 112.198 -179.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.14 8.01 64.18 Favored Glycine 0 C--N 1.332 0.335 0 C-N-CA 120.981 -0.628 . . . . 0.0 113.71 179.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.3 m -134.38 164.18 28.01 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 117.341 0.571 . . . . 0.0 111.43 -179.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -79.98 146.0 32.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.833 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 651' ' ' LEU . . . . . 0.419 ' HB3' ' CG2' ' A' ' 646' ' ' ILE . 0.0 OUTLIER -134.54 144.93 48.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.381 -179.824 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -96.91 109.8 22.44 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.859 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 6.8 mp -54.17 -35.96 62.86 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.284 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -65.59 -43.47 89.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.109 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -73.01 -34.73 66.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.61 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 656' ' ' PHE . . . . . 0.436 ' CZ ' ' HG ' ' A' ' 682' ' ' LEU . 0.2 OUTLIER -70.92 -47.98 56.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.801 179.866 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -58.71 -52.81 64.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.098 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 2.6 ptm85 -59.1 -40.14 84.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.853 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . 0.418 HD23 ' CA ' ' A' ' 678' ' ' LEU . 0.6 OUTLIER -60.47 -48.78 80.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.332 -179.704 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 660' ' ' ILE . . . . . 0.418 ' CG2' ' HA ' ' A' ' 666' ' ' MET . 29.2 mt -56.71 -45.22 82.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-O 120.834 0.349 . . . . 0.0 110.561 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -63.96 -39.79 94.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.915 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -74.48 -13.9 60.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.486 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -94.24 36.63 1.13 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.716 0.294 . . . . 0.0 111.164 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 73.64 31.57 60.44 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.365 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 82.47 173.15 48.83 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.365 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 666' ' ' MET . . . . . 0.492 ' HE3' ' CZ ' ' A' ' 699' ' ' TYR . 0.0 OUTLIER -71.17 -40.55 71.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.738 0.304 . . . . 0.0 111.062 179.985 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -52.57 -43.77 65.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.453 -179.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 668' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.81 -40.86 95.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.935 0.398 . . . . 0.0 110.832 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 58.7 t -57.88 -55.82 19.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.434 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 670' ' ' THR . . . . . . . . . . . . . 8.8 t -75.98 -53.88 7.71 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -178.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -54.21 -50.97 65.88 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -178.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 25.0 mt -77.77 -1.75 32.95 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 -179.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 24.4 mttt 49.46 82.7 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 121.09 0.471 . . . . 0.0 110.433 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 40.0 mttt -146.31 22.47 1.34 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.926 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 675' ' ' TRP . . . . . 0.786 ' HB3' HD23 ' A' ' 695' ' ' LEU . 31.9 m95 -57.24 -31.02 65.11 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 121.445 0.64 . . . . 0.0 110.073 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -56.84 -40.79 76.72 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.411 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.52 -51.62 10.42 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 120.776 0.322 . . . . 0.0 111.409 -179.545 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.774 HD23 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -57.48 -37.4 72.86 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.591 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 679' ' ' ALA . . . . . 0.434 ' N ' ' CD2' ' A' ' 678' ' ' LEU . . . -71.48 -37.54 71.29 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.429 179.284 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -53.09 -46.29 68.57 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.314 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 35.0 mtp -65.24 -24.51 67.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.564 179.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 682' ' ' LEU . . . . . 0.436 ' HG ' ' CZ ' ' A' ' 656' ' ' PHE . 3.3 mm? -78.15 -2.07 35.73 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.535 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . 0.429 ' HB2' ' O ' ' A' ' 682' ' ' LEU . 1.6 mpp_? 68.68 71.79 0.28 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.883 0.373 . . . . 0.0 111.401 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . 0.437 HG21 ' HD2' ' A' ' 685' ' ' PRO . 1.9 mp -124.25 137.53 29.26 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.352 179.525 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . 0.437 ' HD2' HG21 ' A' ' 684' ' ' ILE . 24.8 Cg_endo -62.04 116.08 3.24 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.332 2.022 . . . . 0.0 112.298 -179.821 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -20.19 66.33 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.95 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 12.7 p -67.65 -23.87 65.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.204 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -64.64 111.02 2.55 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.986 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 19.9 mm-40 -83.06 4.85 24.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.559 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -121.78 -16.64 7.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.65 179.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 691' ' ' ARG . . . . . 0.473 ' O ' ' HB3' ' A' ' 695' ' ' LEU . 2.3 ppt_? -52.66 -32.07 40.37 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.473 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . 0.428 HD23 ' CD ' ' A' ' 691' ' ' ARG . 2.7 mm? -70.51 -54.54 11.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.729 0.299 . . . . 0.0 111.488 -179.785 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.78 -39.03 70.19 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.406 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.55 -37.36 87.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.979 0.419 . . . . 0.0 109.98 179.442 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . 0.786 HD23 ' HB3' ' A' ' 675' ' ' TRP . 3.9 tp -65.54 -47.76 74.77 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.854 179.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . 0.416 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 14.7 tt0 -55.19 -47.8 74.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.254 -179.621 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -77.2 -29.81 54.46 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.247 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 698' ' ' ALA . . . . . 0.417 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.78 -37.06 81.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.754 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 699' ' ' TYR . . . . . 0.492 ' CZ ' ' HE3' ' A' ' 666' ' ' MET . 1.4 p90 -86.28 -34.95 20.21 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.008 0.432 . . . . 0.0 110.361 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 700' ' ' CYS . . . . . . . . . . . . . 1.7 m -64.23 -30.57 71.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.784 179.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 25.0 tt0 -97.3 -3.44 40.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.451 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 702' ' ' TYR . . . . . 0.425 ' CZ ' HG23 ' A' ' 638' ' ' ILE . 5.6 m-85 -117.42 -78.59 0.58 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.824 0.345 . . . . 0.0 111.315 -179.716 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 77.9 mt -58.29 -45.78 87.32 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.532 -179.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . 0.44 HD21 ' CE1' ' A' ' 699' ' ' TYR . 1.1 mm? -55.25 -49.05 73.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.919 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 2.2 m -54.68 -55.68 27.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.299 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 706' ' ' TYR . . . . . 0.441 ' HA ' ' CD2' ' A' ' 632' ' ' HIS . 14.3 t80 -47.44 -38.63 13.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.689 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -96.89 0.28 48.84 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -81.35 -19.71 42.19 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 709' ' ' LEU . . . . . 0.468 HD12 ' CE1' ' A' ' 632' ' ' HIS . 0.0 OUTLIER -92.27 -176.64 4.41 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.002 0.43 . . . . 0.0 111.458 -179.599 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 710' ' ' SER . . . . . 0.442 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.6 OUTLIER -84.7 168.59 20.19 Favored Pre-proline 0 C--N 1.331 -0.208 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.997 -179.804 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . 0.442 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 19.0 Cg_endo -59.01 -19.37 47.98 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.596 2.198 . . . . 0.0 112.569 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -59.36 -52.41 65.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.764 0.316 . . . . 0.0 110.73 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 713' ' ' GLU . . . . . 0.415 ' HB2' ' HG ' ' A' ' 709' ' ' LEU . 4.8 mm-40 -64.19 -25.69 68.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.842 179.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -74.42 -54.7 7.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.094 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.19 -34.78 79.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.394 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.08 -53.97 25.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.75 0.309 . . . . 0.0 111.045 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 43.8 mt -65.4 -36.73 84.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.055 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -71.7 -54.22 11.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.482 179.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 2.5 mmtm -54.55 -30.91 55.39 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.207 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 720' ' ' GLU . . . . . 0.419 ' O ' ' HG2' ' A' ' 723' ' ' MET . 3.4 mm-40 -71.56 -55.8 7.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.991 0.424 . . . . 0.0 110.508 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 42.3 t -62.8 -50.75 78.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.915 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 9.4 mp -56.93 -37.97 72.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.89 -179.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 723' ' ' MET . . . . . 0.419 ' HG2' ' O ' ' A' ' 720' ' ' GLU . 13.7 ptp -74.16 -39.13 63.46 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.26 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 724' ' ' GLU . . . . . 0.413 ' N ' ' HG3' ' A' ' 723' ' ' MET . 3.8 mt-10 -60.52 -31.0 70.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.057 -179.783 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 725' ' ' LYS . . . . . . . . . . . . . 9.5 pttt -86.09 -41.04 15.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.304 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -69.97 -50.6 40.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.155 -179.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 727' ' ' ILE . . . . . . . . . . . . . 4.2 mp -88.13 11.61 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.631 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 2.5 tt -57.8 -45.49 85.99 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.808 0.337 . . . . 0.0 111.058 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -60.7 -56.24 23.6 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.985 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 28.5 mtmt . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.878 -179.883 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 619' ' ' TRP . . . . . 0.448 ' CE2' ' HD2' ' A' ' 725' ' ' LYS . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.16 0 CA-C-O 120.562 0.22 . . . . 0.0 111.43 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 116.63 158.25 11.24 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.438 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.81 -37.62 15.44 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.589 2.193 . . . . 0.0 112.048 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -67.73 -33.54 75.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.73 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 623' ' ' VAL . . . . . 0.439 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 60.5 t -70.15 -42.59 79.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.59 179.591 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 42.6 tp60 -62.92 -38.11 89.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.46 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.37 -49.63 74.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.395 179.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 9.8 tt -67.7 -28.55 67.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.828 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -73.86 -49.21 26.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.139 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -58.81 -48.15 82.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.026 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 20.5 mt -65.28 -38.84 83.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.984 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.02 -47.26 85.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.893 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -63.63 -40.22 96.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.984 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 632' ' ' HIS . . . . . 0.452 ' CE1' ' CD1' ' A' ' 709' ' ' LEU . 75.8 t60 -67.85 -42.89 80.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.858 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . 0.418 HD21 ' CD2' ' A' ' 702' ' ' TYR . 13.7 mt -56.58 -49.93 73.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.13 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -61.47 -41.54 97.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.67 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 11.8 t -73.56 -16.88 61.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.158 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -93.72 -9.58 37.23 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.57 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 119.95 -10.08 11.19 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.576 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 638' ' ' ILE . . . . . 0.431 HG21 ' CE2' ' A' ' 702' ' ' TYR . 3.3 mp -98.96 104.67 16.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.733 0.302 . . . . 0.0 111.114 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 1.2 m -77.18 113.12 14.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.889 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 1.9 mtp -128.37 31.01 5.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.887 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -62.89 -39.3 94.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.937 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -66.95 -77.83 0.07 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.001 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -176.43 140.96 0.53 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.839 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -78.23 147.95 23.71 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.604 2.203 . . . . 0.0 112.499 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 4.8 tp -141.36 150.9 43.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.201 0.524 . . . . 0.0 111.159 179.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 646' ' ' ILE . . . . . 0.405 ' CG2' ' HB3' ' A' ' 651' ' ' LEU . 0.8 OUTLIER -149.58 132.99 7.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.634 179.004 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.04 41.02 59.43 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.339 -0.934 . . . . 0.0 112.176 -179.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 69.96 6.91 58.14 Favored Glycine 0 C--N 1.333 0.373 0 C-N-CA 120.969 -0.634 . . . . 0.0 113.786 179.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.8 m -131.23 162.13 30.69 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 117.372 0.586 . . . . 0.0 111.512 -179.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.92 144.04 37.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.773 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 651' ' ' LEU . . . . . 0.405 ' HB3' ' CG2' ' A' ' 646' ' ' ILE . 0.0 OUTLIER -135.39 145.11 46.99 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.098 0.475 . . . . 0.0 111.296 -179.638 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -96.93 110.75 23.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.897 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -52.19 -30.15 25.72 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.976 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -71.69 -44.64 63.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.044 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 4.2 t -69.36 -34.42 74.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.547 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 656' ' ' PHE . . . . . 0.4 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.2 OUTLIER -71.29 -47.02 59.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.778 179.847 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -56.83 -50.89 71.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.841 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 5.9 mtm180 -60.2 -41.63 93.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.718 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.66 -48.33 75.2 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.98 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 660' ' ' ILE . . . . . 0.492 ' CG2' ' HA ' ' A' ' 666' ' ' MET . 14.0 mt -59.94 -44.64 94.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.827 179.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 13.4 t30 -61.02 -44.43 97.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.888 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -67.14 -13.95 62.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.352 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 36.5 mmm -94.57 36.49 1.16 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.776 0.322 . . . . 0.0 111.102 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 65.04 44.24 94.64 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.588 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 81.51 172.73 47.21 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.549 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 666' ' ' MET . . . . . 0.492 ' HA ' ' CG2' ' A' ' 660' ' ' ILE . 0.0 OUTLIER -73.01 -31.66 64.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.744 0.307 . . . . 0.0 111.123 179.919 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 667' ' ' GLN . . . . . 0.405 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 12.6 pt20 -56.94 -44.09 82.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.185 -179.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 668' ' ' GLN . . . . . 0.41 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -64.87 -52.15 58.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.956 0.408 . . . . 0.0 110.842 -179.901 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 80.4 t -49.25 -55.77 3.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.619 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 670' ' ' THR . . . . . 0.415 ' HB ' ' CE ' ' A' ' 666' ' ' MET . 14.5 t -76.28 -50.29 14.76 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -178.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 671' ' ' ASP . . . . . 0.405 ' CB ' ' O ' ' A' ' 667' ' ' GLN . 6.1 t0 -63.32 -51.25 66.79 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -177.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 672' ' ' LEU . . . . . 0.41 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 10.5 mp -76.68 2.68 13.48 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -178.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 48.89 85.62 0.03 OUTLIER 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.987 0.423 . . . . 0.0 110.494 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -147.13 22.07 1.21 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.209 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 675' ' ' TRP . . . . . 0.75 ' CE3' HD22 ' A' ' 678' ' ' LEU . 38.1 m95 -60.15 -27.47 67.11 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 121.358 0.599 . . . . 0.0 110.16 179.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -55.44 -44.36 76.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.714 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 12.1 mttm -77.08 -51.6 10.76 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 120.748 0.309 . . . . 0.0 111.539 -179.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.75 HD22 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.43 -40.94 72.15 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 109.786 -0.449 . . . . 0.0 109.786 179.694 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 679' ' ' ALA . . . . . 0.405 ' N ' ' CD2' ' A' ' 678' ' ' LEU . . . -71.62 -35.06 70.33 Favored 'General case' 0 C--N 1.334 -0.073 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.828 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -53.21 -47.64 68.78 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.504 179.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -19.19 65.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.066 179.628 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 682' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -80.99 -2.8 49.35 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.632 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 73.68 71.88 0.12 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.869 0.366 . . . . 0.0 111.465 179.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . 0.441 HG22 ' HD2' ' A' ' 685' ' ' PRO . 3.2 mp -134.25 138.46 30.41 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.323 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . 0.441 ' HD2' HG22 ' A' ' 684' ' ' ILE . 28.1 Cg_endo -63.0 125.35 15.7 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.498 2.132 . . . . 0.0 112.763 -179.514 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -69.96 -23.9 63.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.023 179.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.36 -23.93 67.11 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.289 -179.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -71.34 109.16 5.17 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.826 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -70.79 -68.88 0.4 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.971 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -52.52 -18.53 1.75 Allowed 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 691' ' ' ARG . . . . . 0.42 ' HD3' HD22 ' A' ' 692' ' ' LEU . 0.0 OUTLIER -50.25 -33.96 21.48 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.795 0.331 . . . . 0.0 110.779 179.764 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . 0.42 HD22 ' HD3' ' A' ' 691' ' ' ARG . 4.3 mm? -70.27 -48.04 58.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.913 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.1 -38.41 69.36 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.316 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 2.7 tptt -61.71 -40.63 95.7 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.088 0.47 . . . . 0.0 110.117 179.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . 0.642 HD22 ' HB3' ' A' ' 675' ' ' TRP . 0.3 OUTLIER -66.89 -43.79 82.54 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.399 179.551 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . 0.476 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 5.2 tp60 -55.42 -46.91 76.63 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.76 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -77.18 -29.37 54.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.753 179.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 698' ' ' ALA . . . . . 0.429 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -68.1 -40.58 82.57 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.64 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 699' ' ' TYR . . . . . 0.498 ' CD2' ' CZ2' ' A' ' 675' ' ' TRP . 0.7 OUTLIER -84.16 -31.13 25.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.955 0.407 . . . . 0.0 110.657 -179.94 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 700' ' ' CYS . . . . . 0.43 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 41.7 t -67.69 -30.4 69.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.877 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -101.14 -1.78 33.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.787 -179.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 702' ' ' TYR . . . . . 0.431 ' CE2' HG21 ' A' ' 638' ' ' ILE . 4.3 m-85 -115.55 -78.85 0.58 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.809 0.337 . . . . 0.0 111.7 -179.508 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 2.7 tp -63.2 -38.85 92.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.829 -179.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . 0.43 ' HB2' ' O ' ' A' ' 700' ' ' CYS . 0.6 OUTLIER -50.83 -56.66 11.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.471 -179.557 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 22.7 p -54.42 -49.32 70.23 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.173 -179.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 706' ' ' TYR . . . . . . . . . . . . . 10.5 t80 -62.36 -29.14 70.25 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.345 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -96.8 -1.27 46.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.823 -179.563 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 1.5 t -112.31 -18.18 12.56 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.603 0.239 . . . . 0.0 111.501 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 709' ' ' LEU . . . . . 0.452 ' CD1' ' CE1' ' A' ' 632' ' ' HIS . 0.2 OUTLIER -74.09 175.19 7.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.759 0.314 . . . . 0.0 110.992 -179.918 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.44 166.15 47.4 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.228 -179.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -67.94 -27.45 36.69 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.646 2.23 . . . . 0.0 112.119 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -52.2 -50.51 61.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.633 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 713' ' ' GLU . . . . . 0.445 ' HB2' ' CD1' ' A' ' 709' ' ' LEU . 3.3 mm-40 -58.08 -26.6 62.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.193 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 714' ' ' HIS . . . . . 0.421 ' CD2' HD22 ' A' ' 709' ' ' LEU . 5.6 m170 -75.88 -53.62 8.17 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.935 0.398 . . . . 0.0 110.61 179.732 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 4.4 tpp180 -59.78 -45.32 92.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.385 -179.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -54.23 31.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.443 -179.452 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 71.2 mt -62.04 -44.06 97.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.816 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -64.72 -53.78 41.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.164 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 6.7 mmtt -50.15 -34.22 21.63 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.152 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 720' ' ' GLU . . . . . 0.411 ' O ' ' HG2' ' A' ' 723' ' ' MET . 1.1 mm-40 -68.16 -55.47 12.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.012 0.434 . . . . 0.0 110.404 179.521 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 31.3 t -62.84 -54.98 26.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.977 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 1.2 mp -49.0 -43.76 40.52 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.765 -179.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 723' ' ' MET . . . . . 0.411 ' HG2' ' O ' ' A' ' 720' ' ' GLU . 17.4 ptp -73.6 -41.31 63.01 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.456 -0.498 . . . . 0.0 109.792 179.416 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -57.37 -29.47 64.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.461 -179.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 725' ' ' LYS . . . . . 0.448 ' HD2' ' CE2' ' A' ' 619' ' ' TRP . 9.4 ptmm? -86.02 -38.88 17.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.329 -179.694 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -71.3 -49.92 37.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.017 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 727' ' ' ILE . . . . . . . . . . . . . 3.7 mp -88.36 11.45 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.629 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 1.6 tt -58.77 -49.48 77.49 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.824 0.345 . . . . 0.0 110.94 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -71.89 -46.1 58.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 10.3 mtpt . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.878 -179.965 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 619' ' ' TRP . . . . . 0.44 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.124 0 CA-C-O 120.671 0.272 . . . . 0.0 111.183 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 119.0 166.12 13.36 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.495 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -67.54 -36.49 19.64 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.508 2.139 . . . . 0.0 112.127 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -65.01 -42.17 94.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.842 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 623' ' ' VAL . . . . . 0.44 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 47.4 t -68.53 -37.09 77.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.926 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 6.3 tm0? -62.1 -41.81 98.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.8 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.64 -47.03 76.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.679 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 7.1 tt -67.07 -26.62 66.82 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.96 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -73.95 -54.06 8.74 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.363 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 30.8 p -57.92 -41.83 83.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.03 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 29.0 mt -69.28 -42.52 81.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.816 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.48 -43.87 98.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.765 179.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 1.6 tttm -63.01 -42.21 99.78 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.852 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 632' ' ' HIS . . . . . 0.452 ' CE1' ' CD1' ' A' ' 709' ' ' LEU . 77.8 t60 -67.41 -42.4 83.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.898 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 58.0 mt -55.9 -49.48 73.3 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.338 -179.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 634' ' ' ARG . . . . . 0.481 ' HG3' ' N ' ' A' ' 635' ' ' SER . 0.0 OUTLIER -64.22 -40.44 96.05 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.937 -179.972 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 635' ' ' SER . . . . . 0.481 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 0.1 OUTLIER -73.89 -16.09 61.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.142 179.765 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 636' ' ' GLN . . . . . 0.444 ' CG ' ' CE1' ' A' ' 632' ' ' HIS . 14.0 mm-40 -94.44 -10.23 33.07 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.564 -179.669 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 120.22 -11.97 10.58 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.573 -0.822 . . . . 0.0 112.522 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 638' ' ' ILE . . . . . 0.448 HG23 ' CE2' ' A' ' 702' ' ' TYR . 5.3 mp -94.25 104.7 16.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 120.668 0.27 . . . . 0.0 111.194 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.42 109.08 15.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.844 0.354 . . . . 0.0 110.994 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 1.4 mtp -119.13 28.89 7.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.891 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -66.68 -31.84 72.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.888 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -72.73 -78.61 0.09 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.878 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 1.3 pp -178.87 126.79 0.26 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.947 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -75.54 131.03 13.26 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.459 2.106 . . . . 0.0 112.274 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 4.1 tp -126.43 152.47 46.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.206 0.527 . . . . 0.0 111.13 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 646' ' ' ILE . . . . . 0.408 ' CG2' ' HB3' ' A' ' 651' ' ' LEU . 1.2 tt -149.57 133.26 8.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.832 179.174 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 54.15 38.87 62.27 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.239 -0.981 . . . . 0.0 111.93 -179.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.45 7.55 60.97 Favored Glycine 0 CA--C 1.52 0.389 0 C-N-CA 121.085 -0.579 . . . . 0.0 113.626 179.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 11.0 m -133.82 164.15 27.9 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 117.366 0.583 . . . . 0.0 111.557 -179.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -78.92 145.75 33.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.761 179.694 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 651' ' ' LEU . . . . . 0.408 ' HB3' ' CG2' ' A' ' 646' ' ' ILE . 0.0 OUTLIER -134.94 145.05 47.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.406 -179.745 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -96.9 111.76 23.82 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.984 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -53.06 -35.49 59.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.097 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -67.88 -46.19 72.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.231 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 4.7 t -69.15 -38.22 78.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.608 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 656' ' ' PHE . . . . . 0.467 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.3 OUTLIER -68.73 -47.25 66.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.892 179.813 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -60.33 -50.97 71.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.011 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -56.03 -43.44 77.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.102 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.68 -47.55 82.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.17 -179.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 660' ' ' ILE . . . . . 0.469 ' CG2' ' HA ' ' A' ' 666' ' ' MET . 24.7 mt -56.87 -45.09 83.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.8 0.333 . . . . 0.0 110.825 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -62.41 -44.97 95.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.726 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -66.84 -14.13 62.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.251 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.93 36.44 1.2 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.718 0.294 . . . . 0.0 110.979 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 68.97 35.65 79.51 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.658 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 84.02 172.46 48.94 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.542 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 666' ' ' MET . . . . . 0.472 ' HE1' ' CZ ' ' A' ' 699' ' ' TYR . 9.0 tpt -70.99 -28.94 64.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.66 0.267 . . . . 0.0 111.041 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 667' ' ' GLN . . . . . 0.442 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 12.4 pt20 -57.21 -43.74 83.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.25 -179.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 668' ' ' GLN . . . . . 0.423 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -66.63 -52.69 42.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.941 0.4 . . . . 0.0 110.913 179.979 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 53.2 t -49.37 -55.65 3.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.627 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 670' ' ' THR . . . . . 0.402 HG23 ' O ' ' A' ' 666' ' ' MET . 14.9 t -76.39 -48.89 18.26 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 113.857 1.058 . . . . 0.0 113.857 -178.474 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 671' ' ' ASP . . . . . 0.442 ' CB ' ' O ' ' A' ' 667' ' ' GLN . 17.5 t0 -65.65 -51.22 61.25 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -177.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 672' ' ' LEU . . . . . 0.423 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 8.7 mp -76.92 3.24 12.56 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 -179.154 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 49.22 84.47 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.962 0.41 . . . . 0.0 110.426 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 1.9 ttmt -144.72 21.86 1.63 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.263 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 675' ' ' TRP . . . . . 0.746 ' CE3' HD23 ' A' ' 678' ' ' LEU . 36.3 m95 -60.26 -28.52 68.13 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.369 0.604 . . . . 0.0 110.089 179.694 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -55.64 -44.51 77.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.643 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 1.7 ttpt -76.85 -51.55 11.09 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 120.704 0.287 . . . . 0.0 111.634 -179.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.746 HD23 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.56 -41.84 73.83 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 179.798 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 679' ' ' ALA . . . . . 0.406 ' CB ' ' NH2' ' A' ' 691' ' ' ARG . . . -71.48 -34.18 69.94 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-O 120.875 0.369 . . . . 0.0 110.521 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.34 -46.35 69.47 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.389 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 4.9 ttm -65.52 -21.05 66.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.837 179.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 682' ' ' LEU . . . . . 0.472 ' O ' ' HB2' ' A' ' 683' ' ' ARG . 2.7 mm? -79.96 -1.4 39.34 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.428 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . 0.472 ' HB2' ' O ' ' A' ' 682' ' ' LEU . 1.8 mpt_? 72.1 71.85 0.16 Allowed 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.959 0.409 . . . . 0.0 111.37 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . 0.439 HG23 ' HD2' ' A' ' 685' ' ' PRO . 3.1 mp -133.57 138.28 30.78 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.328 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . 0.439 ' HD2' HG23 ' A' ' 684' ' ' ILE . 21.7 Cg_endo -61.68 125.3 16.36 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.591 2.194 . . . . 0.0 112.679 -179.514 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.86 -26.03 64.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.954 179.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.52 -23.84 66.98 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.224 -179.817 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -68.96 109.15 3.8 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.916 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -71.74 -68.93 0.42 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.889 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -51.4 -21.28 2.2 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.771 -179.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 691' ' ' ARG . . . . . 0.406 ' NH2' ' CB ' ' A' ' 679' ' ' ALA . 0.0 OUTLIER -49.87 -35.22 22.6 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.881 0.372 . . . . 0.0 110.687 179.677 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -70.41 -47.21 61.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.074 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.13 -39.14 69.04 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.451 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 7.1 mttp -61.87 -41.32 97.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.09 0.471 . . . . 0.0 110.255 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . 0.7 HD22 ' HB3' ' A' ' 675' ' ' TRP . 0.4 OUTLIER -67.32 -43.91 80.46 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.471 179.784 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . 0.427 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 1.3 tt0 -55.24 -46.22 76.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.87 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -77.56 -29.69 52.31 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.074 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 698' ' ' ALA . . . . . 0.42 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.38 -39.25 85.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.544 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 699' ' ' TYR . . . . . 0.472 ' CE1' HD23 ' A' ' 704' ' ' LEU . 1.0 OUTLIER -84.99 -32.56 22.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.928 0.394 . . . . 0.0 110.512 179.881 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 700' ' ' CYS . . . . . 0.427 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 1.7 m -65.21 -30.28 71.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.714 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -100.91 -1.9 33.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.615 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 702' ' ' TYR . . . . . 0.448 ' CE2' HG23 ' A' ' 638' ' ' ILE . 4.8 m-85 -116.33 -79.59 0.59 Allowed 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 120.813 0.34 . . . . 0.0 111.524 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 1.6 tp -61.52 -40.51 94.89 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.722 -179.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . 0.472 HD23 ' CE1' ' A' ' 699' ' ' TYR . 0.4 OUTLIER -48.31 -56.94 6.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.886 0.374 . . . . 0.0 111.429 -179.566 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 12.9 p -54.63 -47.33 73.61 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.383 -179.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 706' ' ' TYR . . . . . 0.485 ' CE1' ' CD2' ' A' ' 714' ' ' HIS . 10.2 t80 -66.13 -29.44 69.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.591 -179.503 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -96.71 -0.09 48.8 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 6.9 t -116.92 -15.77 10.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.541 0.21 . . . . 0.0 111.523 -179.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 709' ' ' LEU . . . . . 0.452 ' CD1' ' CE1' ' A' ' 632' ' ' HIS . 0.2 OUTLIER -73.96 175.14 7.65 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.751 0.31 . . . . 0.0 110.934 -179.949 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.41 164.51 59.14 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.958 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -66.5 -30.88 43.01 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.604 2.203 . . . . 0.0 111.961 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -48.94 -50.2 36.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.831 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 713' ' ' GLU . . . . . 0.433 ' HB2' ' CD1' ' A' ' 709' ' ' LEU . 3.5 mm-40 -58.26 -29.35 65.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.891 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 714' ' ' HIS . . . . . 0.485 ' CD2' ' CE1' ' A' ' 706' ' ' TYR . 1.8 m170 -75.76 -53.96 7.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.497 179.485 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 1.9 mtp-105 -60.22 -47.79 84.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.38 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.06 -54.05 40.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.553 -179.369 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 84.8 mt -62.89 -42.38 99.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.128 -179.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -67.37 -54.22 22.5 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.502 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -51.04 -33.66 26.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.323 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 720' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.42 -55.68 9.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.974 0.416 . . . . 0.0 110.563 179.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 23.3 t -63.44 -54.94 26.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.143 -179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -50.36 -43.29 54.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.779 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 723' ' ' MET . . . . . 0.412 ' HG3' ' N ' ' A' ' 724' ' ' GLU . 13.4 ptp -72.12 -40.53 68.04 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.079 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 724' ' ' GLU . . . . . 0.412 ' N ' ' HG3' ' A' ' 723' ' ' MET . 2.2 mt-10 -52.41 -37.7 57.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.272 -179.727 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 725' ' ' LYS . . . . . 0.412 ' HD3' ' CZ2' ' A' ' 619' ' ' TRP . 0.0 OUTLIER -86.05 -45.71 11.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.227 -179.786 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -59.67 -55.75 30.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.199 -179.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 727' ' ' ILE . . . . . . . . . . . . . 4.2 mp -88.73 11.76 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.591 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 7.3 tt -48.93 -31.73 7.82 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.757 0.313 . . . . 0.0 111.213 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -61.09 -46.21 91.57 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.858 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.208 -0.901 . . . . 0.0 110.807 179.866 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 619' ' ' TRP . . . . . 0.434 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.135 0 CA-C-O 120.67 0.271 . . . . 0.0 111.347 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 117.84 160.16 11.55 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.45 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -67.08 -33.73 30.81 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.57 2.18 . . . . 0.0 112.081 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -68.13 -34.8 77.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.813 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 623' ' ' VAL . . . . . 0.434 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 56.1 t -71.11 -45.32 72.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.582 179.576 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 624' ' ' GLN . . . . . 0.404 ' HG2' ' CD1' ' A' ' 722' ' ' LEU . 34.9 tp60 -59.47 -37.84 79.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.42 179.573 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.84 -50.75 69.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.256 179.431 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 9.3 tt -67.78 -28.69 67.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.712 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -72.03 -51.32 22.33 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.09 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.13 -47.85 80.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.935 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 38.8 mt -63.63 -37.58 80.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.828 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp -63.88 -47.52 80.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.79 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 5.3 tttm -60.28 -40.1 89.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.875 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 632' ' ' HIS . . . . . 0.454 ' CE1' ' CG ' ' A' ' 636' ' ' GLN . 73.7 t60 -70.87 -42.82 69.57 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.986 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . 0.415 HD22 ' CD2' ' A' ' 702' ' ' TYR . 20.1 mt -57.63 -50.06 74.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.222 -179.692 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 3.3 ptt85 -62.96 -44.12 96.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.817 0.341 . . . . 0.0 110.822 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.69 -11.56 60.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.221 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 636' ' ' GLN . . . . . 0.454 ' CG ' ' CE1' ' A' ' 632' ' ' HIS . 23.4 mm-40 -97.2 -7.84 31.43 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.572 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 111.89 6.75 24.32 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.375 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 638' ' ' ILE . . . . . . . . . . . . . 18.0 mt -117.03 107.86 23.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 CA-C-O 120.679 0.276 . . . . 0.0 111.318 -179.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -82.55 113.61 20.39 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.865 0.364 . . . . 0.0 110.791 179.743 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 2.0 ttp -124.15 35.45 4.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.883 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -69.53 -31.82 70.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.038 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -70.84 -79.01 0.07 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.971 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -178.97 135.02 0.29 Allowed Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.845 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -74.69 138.61 24.07 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.523 2.149 . . . . 0.0 112.29 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 5.0 tp -131.31 149.96 52.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.171 0.51 . . . . 0.0 111.134 179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 646' ' ' ILE . . . . . 0.413 ' CG2' ' HB3' ' A' ' 651' ' ' LEU . 1.2 tt -146.84 131.8 11.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.568 178.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 52.36 44.2 58.23 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.283 -0.961 . . . . 0.0 112.226 -179.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 66.27 8.7 45.65 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 120.925 -0.655 . . . . 0.0 113.773 179.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 33.3 m -131.15 161.95 30.99 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 117.374 0.587 . . . . 0.0 111.377 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -80.09 143.53 33.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.768 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 651' ' ' LEU . . . . . 0.413 ' HB3' ' CG2' ' A' ' 646' ' ' ILE . 0.0 OUTLIER -135.35 145.24 47.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.29 -179.692 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -97.33 110.79 23.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.886 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -52.14 -43.58 64.12 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.128 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -60.89 -43.31 98.63 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.153 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 1.6 t -66.5 -35.5 80.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.803 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 656' ' ' PHE . . . . . 0.417 ' CE1' ' HG ' ' A' ' 682' ' ' LEU . 0.1 OUTLIER -72.78 -43.61 62.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.938 -179.98 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -59.7 -46.62 88.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.854 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 37.8 mtp180 -63.57 -43.87 95.77 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.048 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.36 -49.55 77.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.359 -179.67 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 660' ' ' ILE . . . . . 0.45 ' CG2' ' HA ' ' A' ' 666' ' ' MET . 41.4 mt -56.83 -45.97 83.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.721 0.296 . . . . 0.0 110.889 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -66.88 -46.24 75.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.163 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -56.32 -21.38 23.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.548 -179.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.86 28.64 1.76 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.627 -0.26 . . . . 0.0 111.31 -179.765 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 90.49 -16.85 56.82 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.78 179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 135.79 179.43 16.6 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.32 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 666' ' ' MET . . . . . 0.504 ' HE2' ' CZ ' ' A' ' 699' ' ' TYR . 0.0 OUTLIER -72.64 -40.63 66.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.741 0.305 . . . . 0.0 111.199 -179.954 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 667' ' ' GLN . . . . . 0.4 ' O ' ' HB2' ' A' ' 671' ' ' ASP . 6.6 pm0 -51.13 -43.64 61.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.457 -179.548 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 668' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.8 -52.44 56.82 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.879 0.371 . . . . 0.0 110.925 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 89.5 t -49.33 -54.15 6.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.524 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 670' ' ' THR . . . . . . . . . . . . . 9.6 t -76.18 -54.3 7.01 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -178.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 671' ' ' ASP . . . . . 0.4 ' HB2' ' O ' ' A' ' 667' ' ' GLN . 69.7 m-20 -56.88 -51.18 70.09 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -177.88 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 7.9 mp -77.88 1.62 19.9 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -179.068 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 48.98 83.48 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.951 0.405 . . . . 0.0 110.439 -179.845 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 4.9 mtpm? -144.79 21.51 1.63 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.288 -179.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 675' ' ' TRP . . . . . 0.737 ' HB3' HD21 ' A' ' 695' ' ' LEU . 35.1 m95 -58.34 -29.16 65.72 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 121.338 0.589 . . . . 0.0 110.049 179.654 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -56.8 -41.27 77.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.676 -179.622 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 9.1 mttt -78.54 -51.95 9.2 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 120.774 0.321 . . . . 0.0 111.565 -179.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.727 HD22 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -56.77 -40.72 76.33 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 179.404 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 679' ' ' ALA . . . . . . . . . . . . . . . -71.94 -31.84 66.73 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.301 178.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.28 -48.18 68.53 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.038 179.379 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -62.04 -23.8 66.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.794 179.397 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 682' ' ' LEU . . . . . 0.488 ' O ' ' HB2' ' A' ' 683' ' ' ARG . 3.0 mm? -79.59 -2.42 42.42 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.507 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . 0.488 ' HB2' ' O ' ' A' ' 682' ' ' LEU . 6.3 mmm180 70.49 72.01 0.21 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.933 0.397 . . . . 0.0 111.443 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . 0.442 HG22 ' HD2' ' A' ' 685' ' ' PRO . 2.4 mp -128.52 141.78 42.63 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.456 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . 0.442 ' HD2' HG22 ' A' ' 684' ' ' ILE . 38.1 Cg_endo -68.16 121.33 8.31 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.261 1.974 . . . . 0.0 112.05 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -70.54 -25.08 62.94 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.432 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.37 -18.52 65.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.595 -179.515 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 688' ' ' ALA . . . . . 0.479 ' CB ' ' NE ' ' A' ' 691' ' ' ARG . . . -77.1 111.91 13.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.774 0.321 . . . . 0.0 111.425 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -83.17 -7.6 59.6 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.455 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -97.67 -27.58 14.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.148 0.499 . . . . 0.0 109.926 179.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 691' ' ' ARG . . . . . 0.479 ' NE ' ' CB ' ' A' ' 688' ' ' ALA . 0.3 OUTLIER -52.39 -46.72 66.38 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.32 -179.641 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -59.74 -46.2 89.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.299 -179.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.42 -39.49 67.87 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.823 0.344 . . . . 0.0 111.411 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.39 -41.93 93.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.453 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . 0.737 HD21 ' HB3' ' A' ' 675' ' ' TRP . 1.1 tp -64.7 -44.67 89.51 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.544 179.744 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . 0.438 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 2.2 mm-40 -55.55 -47.75 75.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.879 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -76.41 -29.45 57.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.211 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 698' ' ' ALA . . . . . 0.402 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.56 -37.1 82.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.721 -179.648 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 699' ' ' TYR . . . . . 0.504 ' CZ ' ' HE2' ' A' ' 666' ' ' MET . 1.3 p90 -85.38 -36.83 20.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.932 0.396 . . . . 0.0 110.394 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 700' ' ' CYS . . . . . . . . . . . . . 5.3 m -62.77 -30.47 71.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.546 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -95.89 -4.93 42.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.392 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 702' ' ' TYR . . . . . 0.415 ' CD2' HD22 ' A' ' 633' ' ' LEU . 6.8 m-85 -121.56 -75.47 0.59 Allowed 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.838 0.352 . . . . 0.0 111.257 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -54.01 -48.91 69.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.476 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . 0.407 HD21 ' CE1' ' A' ' 699' ' ' TYR . 1.3 mm? -54.9 -29.57 56.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.099 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 24.5 m -69.74 -55.4 10.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.424 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 706' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -62.8 -29.57 70.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.931 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -85.5 -17.48 36.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.317 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 4.4 m -90.73 -21.91 21.35 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.84 0.352 . . . . 0.0 111.05 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 709' ' ' LEU . . . . . 0.522 ' HB3' ' HB2' ' A' ' 713' ' ' GLU . 60.6 mt -56.53 146.4 25.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.371 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 710' ' ' SER . . . . . 0.437 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.4 OUTLIER -79.39 167.67 32.56 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.607 179.732 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . 0.437 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 9.9 Cg_endo -53.15 -23.06 21.3 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.631 2.221 . . . . 0.0 112.401 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -70.18 -55.21 9.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.852 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 713' ' ' GLU . . . . . 0.522 ' HB2' ' HB3' ' A' ' 709' ' ' LEU . 1.6 mm-40 -63.2 -25.95 68.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.845 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 9.9 m-70 -75.68 -54.69 6.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.116 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -64.9 -38.04 89.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.14 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 33.3 ttt180 -68.19 -54.11 20.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.104 -179.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 35.0 mt -64.58 -37.61 88.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.802 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -71.24 -54.24 11.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.557 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 1.5 mmtt -52.4 -32.46 39.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.771 0.319 . . . . 0.0 111.191 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 720' ' ' GLU . . . . . 0.414 ' O ' ' HG2' ' A' ' 723' ' ' MET . 0.5 OUTLIER -70.02 -55.73 8.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.032 0.444 . . . . 0.0 110.468 179.652 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 21.7 t -63.43 -53.49 44.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.183 -179.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . 0.404 ' CD1' ' HG2' ' A' ' 624' ' ' GLN . 1.2 mp -53.12 -41.0 64.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.998 -179.352 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 723' ' ' MET . . . . . 0.414 ' HG2' ' O ' ' A' ' 720' ' ' GLU . 14.0 ptp -72.0 -38.75 69.6 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.101 179.745 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 40.7 mm-40 -57.33 -33.64 67.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.117 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 725' ' ' LYS . . . . . 0.432 ' HD2' ' CE2' ' A' ' 619' ' ' TRP . 0.0 OUTLIER -86.14 -38.83 17.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.367 -179.704 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -68.41 -50.18 54.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.841 0.353 . . . . 0.0 111.13 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 727' ' ' ILE . . . . . 0.407 ' CG2' ' O ' ' A' ' 727' ' ' ILE . 4.3 mp -88.2 11.47 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.551 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 3.4 tt -59.49 -35.43 74.11 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.867 0.365 . . . . 0.0 110.906 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -79.86 -71.07 0.47 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.991 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 13.1 ptmt . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.917 -179.903 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 619' ' ' TRP . . . . . 0.418 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.1 OUTLIER . . . . . 0 CA--C 1.528 0.115 0 CA-C-O 120.58 0.228 . . . . 0.0 111.349 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 116.6 160.52 12.07 Favored Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.433 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -68.21 -39.03 10.97 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.541 2.161 . . . . 0.0 112.222 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 10.8 p30 -66.24 -34.22 77.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.885 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 623' ' ' VAL . . . . . 0.418 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 44.1 t -68.19 -45.65 82.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.712 179.669 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 624' ' ' GLN . . . . . 0.403 ' HG2' ' CD1' ' A' ' 722' ' ' LEU . 41.2 tp60 -60.95 -39.61 90.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.543 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.52 -50.82 72.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.57 179.702 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 6.7 tt -68.51 -29.71 68.36 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.871 179.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -70.24 -50.27 41.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.373 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.5 -37.1 85.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.346 -179.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 629' ' ' ILE . . . . . 0.449 ' HA ' ' CE1' ' A' ' 632' ' ' HIS . 38.7 mt -63.86 -54.01 37.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.327 -179.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 630' ' ' LYS . . . . . 0.426 ' HG3' ' N ' ' A' ' 631' ' ' LYS . 0.9 OUTLIER -61.69 -32.41 72.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.269 -179.71 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 631' ' ' LYS . . . . . 0.426 ' N ' ' HG3' ' A' ' 630' ' ' LYS . 1.8 tttm -63.1 -50.96 68.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.84 0.352 . . . . 0.0 111.329 -179.704 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 632' ' ' HIS . . . . . 0.463 ' CD2' ' N ' ' A' ' 633' ' ' LEU . 3.5 p-80 -68.31 -39.7 81.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.712 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . 0.463 ' N ' ' CD2' ' A' ' 632' ' ' HIS . 41.8 mt -56.82 -49.84 74.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.144 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 634' ' ' ARG . . . . . 0.456 ' HG3' ' N ' ' A' ' 635' ' ' SER . 11.8 ptt180 -64.08 -39.34 93.85 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.781 0.324 . . . . 0.0 110.615 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 635' ' ' SER . . . . . 0.456 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 75.1 m -73.61 -17.24 61.19 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.011 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.0 -7.17 46.59 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.466 -179.823 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 111.86 3.69 26.53 Favored Glycine 0 C--N 1.331 0.305 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.601 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 638' ' ' ILE . . . . . 0.421 HG21 ' CZ ' ' A' ' 702' ' ' TYR . 17.3 mt -109.66 104.85 17.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-O 120.694 0.283 . . . . 0.0 111.284 -179.413 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -78.05 129.82 35.7 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.952 0.406 . . . . 0.0 111.061 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -129.79 5.59 5.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.466 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -58.56 -26.76 63.91 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.742 0.306 . . . . 0.0 111.248 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -66.43 -80.8 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.953 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -177.11 118.52 0.26 Allowed Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.901 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -65.53 134.49 38.57 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.425 2.083 . . . . 0.0 112.432 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 4.6 tp -144.06 151.5 39.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.336 0.588 . . . . 0.0 111.441 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 646' ' ' ILE . . . . . 0.425 HD12 HD13 ' A' ' 695' ' ' LEU . 1.6 tt -149.65 133.49 8.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.228 -0.896 . . . . 0.0 109.705 178.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 52.65 40.73 56.08 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.302 -0.951 . . . . 0.0 112.218 -179.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.35 6.78 58.91 Favored Glycine 0 C--N 1.332 0.361 0 C-N-CA 120.986 -0.626 . . . . 0.0 113.839 179.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 6.3 m -132.08 163.04 29.34 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 117.413 0.606 . . . . 0.0 111.557 -179.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -78.94 144.27 34.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.727 179.77 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 651' ' ' LEU . . . . . 0.411 ' HB3' ' CG2' ' A' ' 646' ' ' ILE . 0.0 OUTLIER -134.86 144.99 47.86 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.249 -179.751 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -96.58 110.75 23.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.875 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -52.14 -32.68 36.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.163 -179.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -70.1 -44.41 69.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.166 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 14.4 t -69.1 -37.35 78.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.925 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 656' ' ' PHE . . . . . 0.434 ' CD2' HD13 ' A' ' 682' ' ' LEU . 0.3 OUTLIER -68.77 -45.9 70.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.884 -179.912 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -58.36 -49.77 76.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.981 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 1.8 mtt85 -60.04 -42.48 94.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.817 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.67 -50.45 73.14 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.307 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 660' ' ' ILE . . . . . 0.466 ' CG2' ' HA ' ' A' ' 666' ' ' MET . 17.3 mt -56.71 -45.57 82.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.782 0.325 . . . . 0.0 110.841 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -63.47 -45.97 88.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.739 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -65.27 -19.97 66.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.2 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 8.9 mmm -90.2 36.67 0.88 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.477 -179.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 69.55 40.65 77.96 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.65 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 78.53 174.52 44.23 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.613 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 666' ' ' MET . . . . . 0.517 ' HE1' ' CZ ' ' A' ' 699' ' ' TYR . 0.0 OUTLIER -73.01 -34.66 66.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.803 0.335 . . . . 0.0 111.287 -179.981 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -54.67 -45.7 73.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.434 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 668' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -52.37 63.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.955 0.407 . . . . 0.0 110.774 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 669' ' ' VAL . . . . . 0.404 ' HB ' ' HE3' ' A' ' 666' ' ' MET . 75.1 t -49.21 -55.75 3.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.777 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 670' ' ' THR . . . . . 0.413 ' HB ' ' CE ' ' A' ' 666' ' ' MET . 9.2 t -76.05 -51.65 11.84 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 -178.329 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -60.0 -51.2 70.67 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -177.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 10.7 mp -77.16 1.19 19.03 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -178.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 11.6 mtpp 49.36 87.21 0.03 OUTLIER 'General case' 0 CA--C 1.521 -0.163 0 CA-C-O 121.133 0.492 . . . . 0.0 110.385 -179.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -150.08 22.07 0.86 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.199 -179.678 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 675' ' ' TRP . . . . . 0.746 ' CE3' HD21 ' A' ' 678' ' ' LEU . 36.5 m95 -57.83 -28.49 64.13 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 121.444 0.64 . . . . 0.0 109.988 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -55.18 -42.65 73.5 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.608 -179.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.78 -51.64 10.19 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.677 0.275 . . . . 0.0 111.662 -179.337 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.746 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -56.46 -40.07 74.25 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.827 -0.435 . . . . 0.0 109.827 179.771 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 679' ' ' ALA . . . . . 0.415 ' N ' ' CD2' ' A' ' 678' ' ' LEU . . . -71.56 -35.64 70.67 Favored 'General case' 0 C--N 1.334 -0.079 0 CA-C-O 120.763 0.316 . . . . 0.0 110.567 179.199 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -53.03 -47.08 68.64 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.382 179.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 1.8 mtm -65.4 -22.51 66.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.872 179.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 682' ' ' LEU . . . . . 0.468 ' O ' ' HB2' ' A' ' 683' ' ' ARG . 3.5 mm? -78.97 -2.15 38.76 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.576 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . 0.468 ' HB2' ' O ' ' A' ' 682' ' ' LEU . 3.4 mtp180 71.44 72.03 0.17 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.945 0.402 . . . . 0.0 111.608 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . 0.436 HG22 ' HD2' ' A' ' 685' ' ' PRO . 3.2 mp -131.25 140.1 37.49 Favored Pre-proline 0 CA--C 1.532 0.262 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.282 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . 0.436 ' HD2' HG22 ' A' ' 684' ' ' ILE . 32.8 Cg_endo -64.85 123.24 11.35 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.52 2.147 . . . . 0.0 112.756 -179.464 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.97 -23.29 63.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.954 179.637 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.35 -23.73 67.06 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.272 -179.726 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -72.57 111.63 7.91 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.808 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -70.87 -68.83 0.41 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.952 -179.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -53.74 -15.71 1.37 Allowed 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -179.443 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 691' ' ' ARG . . . . . 0.428 ' HD3' HD21 ' A' ' 692' ' ' LEU . 0.0 OUTLIER -51.91 -35.28 44.94 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.79 0.329 . . . . 0.0 110.867 179.83 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . 0.428 HD21 ' HD3' ' A' ' 691' ' ' ARG . 3.5 mm? -70.37 -46.85 63.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.938 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.0 -37.85 69.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.236 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 2.9 mmtp -62.61 -39.91 95.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.087 0.47 . . . . 0.0 110.07 179.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . 0.658 HD22 ' HB3' ' A' ' 675' ' ' TRP . 0.4 OUTLIER -66.8 -44.67 80.62 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.44 179.609 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . 0.454 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 3.0 mt-30 -55.22 -46.17 75.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.757 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -77.23 -29.47 54.14 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.878 179.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 698' ' ' ALA . . . . . 0.418 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -68.94 -39.5 79.53 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.775 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 699' ' ' TYR . . . . . 0.517 ' CZ ' ' HE1' ' A' ' 666' ' ' MET . 0.7 OUTLIER -85.77 -31.33 22.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.937 0.398 . . . . 0.0 110.562 179.971 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 700' ' ' CYS . . . . . 0.444 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 8.6 m -68.14 -30.24 69.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.648 179.601 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.0 -1.25 43.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.411 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 702' ' ' TYR . . . . . 0.421 ' CZ ' HG21 ' A' ' 638' ' ' ILE . 6.1 m-85 -118.69 -78.67 0.59 Allowed 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.871 0.367 . . . . 0.0 111.35 -179.739 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.24 -42.02 90.11 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.712 -179.243 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . 0.448 HD22 ' CE1' ' A' ' 699' ' ' TYR . 0.6 OUTLIER -55.21 -41.61 72.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.874 0.369 . . . . 0.0 111.136 -179.71 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.45 -55.87 28.27 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.408 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 706' ' ' TYR . . . . . 0.434 ' HB2' ' CE1' ' A' ' 632' ' ' HIS . 3.1 t80 -56.34 -47.75 78.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.984 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -66.54 -18.57 65.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.133 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 24.9 p -91.36 -29.38 17.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.802 0.334 . . . . 0.0 110.904 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 709' ' ' LEU . . . . . . . . . . . . . 74.9 mt -61.32 157.56 16.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.902 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -79.11 165.66 47.32 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.711 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -55.52 -22.36 34.58 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.482 2.121 . . . . 0.0 112.172 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -61.87 -54.31 43.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.903 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 713' ' ' GLU . . . . . . . . . . . . . 52.6 mm-40 -60.45 -26.38 66.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.109 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 16.4 m170 -75.98 -54.42 6.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.479 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 715' ' ' ARG . . . . . 0.446 ' HG3' ' N ' ' A' ' 716' ' ' ARG . 0.8 OUTLIER -62.56 -41.33 98.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.464 -179.451 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 716' ' ' ARG . . . . . 0.446 ' N ' ' HG3' ' A' ' 715' ' ' ARG . 0.2 OUTLIER -66.92 -54.0 26.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.844 0.354 . . . . 0.0 111.061 -179.654 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 59.9 mt -63.13 -41.24 99.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.969 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -69.17 -54.3 15.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.552 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.26 -32.35 24.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.167 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 720' ' ' GLU . . . . . 0.419 ' O ' ' HG2' ' A' ' 723' ' ' MET . 1.8 mt-10 -70.17 -55.55 9.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.047 0.451 . . . . 0.0 110.402 179.633 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 20.0 t -62.59 -53.89 41.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.13 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . 0.403 ' CD1' ' HG2' ' A' ' 624' ' ' GLN . 1.1 mp -52.93 -41.3 64.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.046 -179.222 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 723' ' ' MET . . . . . 0.419 ' HG2' ' O ' ' A' ' 720' ' ' GLU . 15.2 ptp -72.97 -40.09 65.59 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.121 179.745 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -57.54 -31.31 65.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.321 -179.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 725' ' ' LYS . . . . . 0.416 ' HD3' ' CE2' ' A' ' 619' ' ' TRP . 3.4 pttp -86.14 -39.83 16.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.402 -179.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -69.86 -51.89 29.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.24 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 727' ' ' ILE . . . . . . . . . . . . . 3.9 mp -87.7 11.63 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.733 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 3.0 tt -56.27 -42.41 77.39 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.82 0.343 . . . . 0.0 111.007 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -75.22 -54.11 7.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.948 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 1.2 mtmm . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.899 179.98 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 619' ' ' TRP . . . . . 0.457 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.154 0 CA-C-O 120.6 0.238 . . . . 0.0 111.345 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 122.15 159.95 10.79 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.498 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -68.42 -32.68 25.01 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.555 2.17 . . . . 0.0 112.025 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -70.74 -33.51 70.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.702 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 623' ' ' VAL . . . . . 0.457 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 57.0 t -76.04 -41.65 38.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.34 179.153 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 7.8 tm0? -59.36 -40.45 86.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.253 179.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.53 -50.93 63.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.301 179.399 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -57.83 -39.49 77.77 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.653 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -69.09 -52.59 26.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.282 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -56.92 -50.54 72.24 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.235 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 25.6 mt -59.29 -39.53 79.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.153 -179.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 7.0 ttpt -63.8 -49.64 72.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.919 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.32 -40.86 78.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.223 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 632' ' ' HIS . . . . . 0.485 ' CE1' ' CD1' ' A' ' 709' ' ' LEU . 85.6 t60 -71.67 -40.9 69.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.039 -179.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . 0.433 HD23 ' CE2' ' A' ' 702' ' ' TYR . 10.2 mt -56.83 -49.9 74.02 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.147 -179.74 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 1.5 ptt180 -65.71 -40.52 92.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.754 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 66.1 m -73.33 -13.74 61.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.25 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 636' ' ' GLN . . . . . 0.401 ' NE2' ' CE1' ' A' ' 632' ' ' HIS . 0.1 OUTLIER -98.06 -4.74 35.32 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 -179.754 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 109.24 5.84 30.01 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.558 -0.83 . . . . 0.0 112.536 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 638' ' ' ILE . . . . . . . . . . . . . 18.1 mt -113.77 108.96 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-O 120.648 0.261 . . . . 0.0 111.277 -179.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -83.67 107.73 16.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.851 0.358 . . . . 0.0 110.913 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 640' ' ' MET . . . . . 0.405 ' HE1' ' HG3' ' A' ' 644' ' ' PRO . 1.6 ttp -117.09 35.14 4.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.817 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -74.61 -37.75 62.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.157 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -62.02 -82.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.052 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 1.7 pp -177.8 117.43 0.25 Allowed Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.949 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 644' ' ' PRO . . . . . 0.405 ' HG3' ' HE1' ' A' ' 640' ' ' MET . 31.7 Cg_exo -59.33 150.94 71.55 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.406 2.071 . . . . 0.0 112.241 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 4.7 tp -144.39 151.4 39.22 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.191 0.52 . . . . 0.0 111.405 179.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 646' ' ' ILE . . . . . 0.418 ' CG2' ' HB3' ' A' ' 651' ' ' LEU . 1.6 tt -149.81 133.87 8.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.688 178.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 52.57 40.12 54.6 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.34 -0.933 . . . . 0.0 112.282 -179.298 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.58 7.42 61.07 Favored Glycine 0 C--N 1.333 0.404 0 C-N-CA 120.964 -0.636 . . . . 0.0 113.658 179.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.7 m -131.99 162.35 30.92 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 117.346 0.573 . . . . 0.0 111.481 -179.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.77 143.84 37.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.825 179.809 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 651' ' ' LEU . . . . . 0.418 ' HB3' ' CG2' ' A' ' 646' ' ' ILE . 0.0 OUTLIER -135.42 145.4 47.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.066 0.46 . . . . 0.0 111.426 -179.588 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -99.18 112.36 24.53 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.754 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -52.64 -39.06 61.4 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.008 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -64.14 -43.73 94.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.003 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 4.2 t -67.57 -39.67 84.91 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.043 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 656' ' ' PHE . . . . . 0.435 ' CD2' ' CD1' ' A' ' 682' ' ' LEU . 0.7 OUTLIER -67.44 -42.74 82.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.708 -179.983 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -59.7 -45.9 90.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.805 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 3.8 mtm180 -63.04 -43.21 99.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.538 179.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.16 -51.45 69.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.966 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 660' ' ' ILE . . . . . 0.421 HG12 ' CD1' ' A' ' 678' ' ' LEU . 67.7 mt -57.68 -45.55 86.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.858 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -59.79 -39.69 85.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.82 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -61.15 -21.73 64.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.151 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 663' ' ' MET . . . . . 0.401 ' CE ' ' HB3' ' A' ' 678' ' ' LEU . 0.0 OUTLIER -88.47 14.38 9.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.627 -179.769 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 86.11 17.63 60.73 Favored Glycine 0 C--N 1.332 0.358 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.926 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 111.49 169.87 18.79 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.592 -0.813 . . . . 0.0 112.71 179.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 666' ' ' MET . . . . . 0.42 ' HE3' ' CE1' ' A' ' 699' ' ' TYR . 0.0 OUTLIER -63.83 -31.93 73.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.768 0.318 . . . . 0.0 111.046 -179.972 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -55.6 -48.19 75.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.443 -179.573 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 668' ' ' GLN . . . . . . . . . . . . . 8.0 mm-40 -62.24 -52.59 63.13 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.842 0.354 . . . . 0.0 111.136 -179.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 60.7 t -50.92 -55.89 5.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.944 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 670' ' ' THR . . . . . 0.414 ' CG2' ' N ' ' A' ' 671' ' ' ASP . 10.8 t -76.17 -53.07 8.82 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 -178.297 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 671' ' ' ASP . . . . . 0.414 ' N ' ' CG2' ' A' ' 670' ' ' THR . 4.4 t70 -57.32 -51.07 70.86 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -177.722 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 9.1 mp -78.7 2.3 20.07 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -178.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 3.8 mmtp 48.27 86.09 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.076 0.465 . . . . 0.0 110.517 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -149.15 21.68 0.96 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.147 -179.855 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 675' ' ' TRP . . . . . 0.74 ' HB3' HD22 ' A' ' 695' ' ' LEU . 31.4 m95 -57.71 -28.4 63.82 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 121.327 0.584 . . . . 0.0 110.145 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -56.07 -42.05 76.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.853 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -77.49 -51.74 10.23 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 120.765 0.316 . . . . 0.0 111.665 -179.261 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.712 HD23 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -57.27 -40.55 77.96 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.677 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 679' ' ' ALA . . . . . . . . . . . . . . . -71.76 -33.63 68.81 Favored 'General case' 0 C--N 1.334 -0.082 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.412 178.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.16 -49.73 66.03 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.319 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 4.5 mtm -64.06 -22.37 66.9 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.867 179.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 682' ' ' LEU . . . . . 0.435 ' CD1' ' CD2' ' A' ' 656' ' ' PHE . 2.5 mm? -78.41 -3.34 42.77 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.526 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . 0.418 ' HB2' ' O ' ' A' ' 682' ' ' LEU . 23.9 mmt85 70.56 71.92 0.2 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.898 0.38 . . . . 0.0 111.546 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . 0.415 HG23 ' HD2' ' A' ' 691' ' ' ARG . 2.1 mp -123.0 142.43 38.14 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.158 179.436 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.86 119.12 6.12 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.499 2.133 . . . . 0.0 112.634 -179.674 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.96 -23.04 63.12 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.045 179.658 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.23 -22.5 66.88 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.463 -179.635 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 688' ' ' ALA . . . . . 0.477 ' O ' ' HG2' ' A' ' 691' ' ' ARG . . . -71.84 117.23 13.18 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.928 0.394 . . . . 0.0 111.075 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.25 3.82 29.61 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.37 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -121.69 -13.89 8.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.155 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 691' ' ' ARG . . . . . 0.477 ' HG2' ' O ' ' A' ' 688' ' ' ALA . 0.2 OUTLIER -55.0 -35.1 64.0 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.811 0.338 . . . . 0.0 110.933 -179.673 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . 0.424 HD22 ' CD ' ' A' ' 691' ' ' ARG . 3.0 mm? -70.6 -47.69 58.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.042 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.93 -39.58 69.36 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.415 -179.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 3.8 mmtt -64.24 -40.78 96.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.241 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . 0.74 HD22 ' HB3' ' A' ' 675' ' ' TRP . 3.9 tp -63.89 -47.04 82.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.844 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . 0.416 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 0.0 OUTLIER -55.27 -49.09 72.96 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.189 -179.743 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -75.19 -29.49 60.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.126 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -68.54 -38.09 80.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.749 -179.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 699' ' ' TYR . . . . . 0.458 ' CD2' ' CZ2' ' A' ' 675' ' ' TRP . 1.0 OUTLIER -86.47 -30.52 21.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.831 0.348 . . . . 0.0 110.736 -179.877 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 700' ' ' CYS . . . . . . . . . . . . . 15.3 t -69.45 -30.51 68.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.644 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -97.46 -1.37 44.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.472 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 702' ' ' TYR . . . . . 0.433 ' CE2' HD23 ' A' ' 633' ' ' LEU . 7.1 m-85 -121.51 -78.64 0.6 Allowed 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.831 0.348 . . . . 0.0 111.316 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 1.1 mp -57.63 -44.55 85.66 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.523 -179.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . 0.447 HD21 ' CE1' ' A' ' 699' ' ' TYR . 1.1 mm? -56.4 -49.41 74.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.86 0.362 . . . . 0.0 110.959 -179.801 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 22.7 m -54.7 -55.29 31.31 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.719 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 706' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -63.77 -29.35 70.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.202 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -79.0 -20.96 47.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.247 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 1.7 m -91.54 -17.59 25.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.283 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 709' ' ' LEU . . . . . 0.485 ' CD1' ' CE1' ' A' ' 632' ' ' HIS . 78.2 mt -58.62 153.12 17.01 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.914 0.387 . . . . 0.0 111.113 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 710' ' ' SER . . . . . 0.446 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.6 OUTLIER -79.06 168.46 26.78 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.473 179.619 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . 0.446 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 14.4 Cg_endo -56.8 -19.78 32.72 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.518 2.145 . . . . 0.0 112.524 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -67.49 -55.55 13.13 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.038 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 713' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -59.34 -26.17 64.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.075 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -75.83 -54.1 7.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.256 179.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 7.0 mtm180 -63.44 -40.82 98.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.428 -179.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.54 -54.08 27.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.755 0.312 . . . . 0.0 111.241 -179.598 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 57.8 mt -64.85 -39.39 93.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.975 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -69.29 -54.2 15.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.561 179.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 9.4 mmtt -52.89 -33.33 49.75 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.378 -179.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 720' ' ' GLU . . . . . 0.407 ' O ' ' HG2' ' A' ' 723' ' ' MET . 12.3 mt-10 -69.56 -55.76 9.23 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.079 0.466 . . . . 0.0 110.623 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 45.8 t -63.76 -53.33 45.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.15 -179.636 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 8.0 mp -54.4 -38.77 66.59 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.865 -179.173 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 723' ' ' MET . . . . . 0.407 ' HG2' ' O ' ' A' ' 720' ' ' GLU . 13.6 ptp -75.38 -40.61 57.82 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.033 179.605 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -54.32 -40.02 67.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.178 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 725' ' ' LYS . . . . . 0.444 ' HE2' ' CD2' ' A' ' 619' ' ' TRP . 0.0 OUTLIER -85.45 -42.64 14.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.097 -179.86 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -59.51 -53.46 57.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.949 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 727' ' ' ILE . . . . . . . . . . . . . 4.2 mp -89.37 11.7 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.551 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 1.7 tt -57.34 -45.56 84.2 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.853 0.359 . . . . 0.0 111.049 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -73.86 -54.71 7.37 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.979 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 6.9 mtmm . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.981 179.998 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 619' ' ' TRP . . . . . 0.434 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.651 0.262 . . . . 0.0 111.284 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 126.11 163.21 11.49 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.491 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -68.52 -37.59 12.66 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.582 2.188 . . . . 0.0 112.241 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -67.35 -38.86 85.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.915 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 623' ' ' VAL . . . . . 0.434 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 40.1 t -70.98 -41.92 76.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.967 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 4.0 tm0? -58.6 -45.53 88.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.712 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 74.5 mtt-85 -62.18 -50.63 71.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.708 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 8.6 tt -61.51 -34.09 74.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.819 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -63.98 -53.76 45.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.185 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -58.97 -42.56 90.25 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.997 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 629' ' ' ILE . . . . . 0.448 ' HA ' ' CE1' ' A' ' 632' ' ' HIS . 38.3 mt -60.32 -51.39 73.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.048 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 4.7 ttpp -60.79 -32.82 72.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.249 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.67 -48.08 76.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.614 -179.507 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 632' ' ' HIS . . . . . 0.502 ' CD2' ' N ' ' A' ' 633' ' ' LEU . 3.3 p-80 -69.47 -39.84 77.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.921 -179.747 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . 0.502 ' N ' ' CD2' ' A' ' 632' ' ' HIS . 20.4 mt -55.86 -48.25 75.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.203 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 634' ' ' ARG . . . . . 0.426 ' HG3' ' N ' ' A' ' 635' ' ' SER . 0.1 OUTLIER -67.01 -39.92 87.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.719 0.295 . . . . 0.0 110.814 179.892 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 635' ' ' SER . . . . . 0.426 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 8.5 m -73.75 -14.03 61.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.42 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.39 -8.26 29.91 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 -179.675 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 118.83 -8.46 12.86 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.583 179.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 638' ' ' ILE . . . . . 0.429 HG22 ' CZ ' ' A' ' 702' ' ' TYR . 3.5 mp -99.5 104.65 16.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.744 0.307 . . . . 0.0 111.03 -179.636 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 3.2 m -80.57 114.12 19.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.885 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 1.8 ttp -122.6 27.85 7.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.932 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.46 -52.8 59.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.888 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -50.55 -72.39 0.05 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.23 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 179.67 134.4 0.25 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.81 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.13 122.96 7.47 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.455 2.103 . . . . 0.0 112.343 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 4.9 tp -125.73 153.39 44.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.305 0.574 . . . . 0.0 111.319 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 646' ' ' ILE . . . . . 0.412 ' CG2' ' HB3' ' A' ' 651' ' ' LEU . 2.2 tt -149.62 133.17 7.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.448 179.156 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 50.59 43.61 45.97 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.246 -0.978 . . . . 0.0 112.138 -179.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 68.58 6.19 48.31 Favored Glycine 0 CA--C 1.52 0.378 0 C-N-CA 121.127 -0.559 . . . . 0.0 113.991 179.304 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 4.0 m -131.27 162.79 29.24 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 117.68 0.74 . . . . 0.0 111.696 -178.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -81.25 142.42 33.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.743 179.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 651' ' ' LEU . . . . . 0.412 ' HB3' ' CG2' ' A' ' 646' ' ' ILE . 0.0 OUTLIER -134.11 144.76 48.78 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.071 0.462 . . . . 0.0 111.099 179.891 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.88 109.43 21.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.926 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -52.21 -42.62 63.69 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.083 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -62.78 -46.34 88.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.272 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 40.4 t -67.69 -37.58 82.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.911 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 656' ' ' PHE . . . . . 0.457 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.2 OUTLIER -68.82 -44.39 73.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.981 -179.898 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -59.96 -46.35 89.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.004 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.14 -43.89 98.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.009 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . 0.42 ' HA ' ' HG2' ' A' ' 662' ' ' GLU . 0.1 OUTLIER -56.7 -45.1 82.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.401 -179.65 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 660' ' ' ILE . . . . . 0.503 ' CG2' ' HA ' ' A' ' 666' ' ' MET . 37.2 mt -62.97 -44.47 99.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.264 -179.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -64.3 -45.2 89.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.641 -179.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . 0.42 ' HG2' ' HA ' ' A' ' 659' ' ' LEU . 18.3 pt-20 -66.36 -14.15 61.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.598 -179.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.67 34.7 1.45 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.803 0.335 . . . . 0.0 111.199 -179.784 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 73.89 32.86 58.41 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.827 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 85.54 172.59 49.07 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.606 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 666' ' ' MET . . . . . 0.508 ' HE3' ' CZ ' ' A' ' 699' ' ' TYR . 10.1 tpt -72.15 -28.87 63.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.643 0.259 . . . . 0.0 111.237 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 667' ' ' GLN . . . . . 0.406 ' O ' ' HB2' ' A' ' 671' ' ' ASP . 18.7 pt20 -55.07 -48.29 73.72 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.106 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 668' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.0 -51.86 65.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.856 0.36 . . . . 0.0 110.812 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 40.7 t -49.19 -55.31 4.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.722 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 670' ' ' THR . . . . . . . . . . . . . 9.7 t -76.02 -50.69 14.12 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -178.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 671' ' ' ASP . . . . . 0.406 ' HB2' ' O ' ' A' ' 667' ' ' GLN . 40.0 m-20 -62.14 -51.27 68.55 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -177.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -78.0 3.55 14.47 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -179.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 1.7 mttt 49.07 86.43 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.996 0.427 . . . . 0.0 110.477 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 27.7 mttt -144.88 22.21 1.59 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.229 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 675' ' ' TRP . . . . . 0.78 ' CE3' HD23 ' A' ' 678' ' ' LEU . 36.6 m95 -61.21 -30.34 70.37 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 121.409 0.624 . . . . 0.0 110.173 179.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -57.02 -43.29 81.69 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.372 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.18 -51.52 11.96 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.802 0.334 . . . . 0.0 111.243 -179.615 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.78 HD23 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.84 -40.29 72.62 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.572 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 679' ' ' ALA . . . . . 0.413 ' N ' ' CD2' ' A' ' 678' ' ' LEU . . . -71.6 -33.68 69.23 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.551 179.107 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -53.77 -49.51 68.09 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.363 179.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 5.4 mtp -62.73 -22.21 66.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.763 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 682' ' ' LEU . . . . . 0.471 ' O ' ' HB2' ' A' ' 683' ' ' ARG . 3.2 mm? -79.28 -1.13 35.22 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.457 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . 0.471 ' HB2' ' O ' ' A' ' 682' ' ' LEU . 0.0 OUTLIER 70.63 71.93 0.2 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.956 0.408 . . . . 0.0 111.343 179.98 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . 0.417 HG23 ' HD2' ' A' ' 685' ' ' PRO . 1.8 mp -124.43 136.99 28.45 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.682 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . 0.417 ' HD2' HG23 ' A' ' 684' ' ' ILE . 36.8 Cg_endo -65.99 125.2 13.75 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.474 2.116 . . . . 0.0 112.361 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.85 -13.94 62.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.393 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.3 -23.18 66.95 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.734 0.302 . . . . 0.0 111.207 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 688' ' ' ALA . . . . . 0.414 ' CB ' ' HB2' ' A' ' 691' ' ' ARG . . . -82.81 107.6 15.55 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.949 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -75.09 -68.33 0.56 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.206 -179.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 70.8 m-20 -54.6 -17.36 3.21 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.811 -179.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 691' ' ' ARG . . . . . 0.414 ' HB2' ' CB ' ' A' ' 688' ' ' ALA . 0.0 OUTLIER -45.93 -40.51 10.31 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.876 0.369 . . . . 0.0 111.299 179.859 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -59.69 -42.06 92.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.056 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.23 -37.23 69.21 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.892 0.377 . . . . 0.0 111.159 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -65.11 -42.96 93.47 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.29 179.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . 0.761 HD21 ' HB3' ' A' ' 675' ' ' TRP . 0.4 OUTLIER -63.98 -43.91 94.31 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.422 179.67 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . 0.445 ' O ' ' CD1' ' A' ' 699' ' ' TYR . 5.1 tp60 -56.17 -44.82 79.71 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.643 179.76 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -77.22 -29.8 54.32 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.176 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 698' ' ' ALA . . . . . 0.445 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.39 -37.53 83.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.729 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 699' ' ' TYR . . . . . 0.512 ' CE2' HD22 ' A' ' 704' ' ' LEU . 2.1 p90 -84.92 -37.62 20.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.969 0.414 . . . . 0.0 110.232 179.646 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 700' ' ' CYS . . . . . 0.417 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 15.3 t -60.88 -30.32 70.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.646 179.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -100.09 -0.42 39.06 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.453 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 702' ' ' TYR . . . . . 0.445 ' CD1' ' O ' ' A' ' 698' ' ' ALA . 5.1 m-85 -117.69 -79.05 0.59 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.78 0.324 . . . . 0.0 111.623 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 5.9 mp -64.41 -40.35 95.61 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.951 -179.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . 0.512 HD22 ' CE2' ' A' ' 699' ' ' TYR . 0.4 OUTLIER -47.44 -56.63 6.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.806 0.336 . . . . 0.0 111.515 -179.593 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.28 -46.12 72.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.251 -179.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 706' ' ' TYR . . . . . 0.456 ' HB2' ' CE1' ' A' ' 632' ' ' HIS . 10.2 t80 -61.95 -29.47 70.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.135 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -95.45 -4.46 45.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.497 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 8.6 p -112.52 -23.19 10.41 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.613 0.244 . . . . 0.0 111.378 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 709' ' ' LEU . . . . . 0.402 ' CD1' ' HB2' ' A' ' 713' ' ' GLU . 0.2 OUTLIER -70.15 172.61 7.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.812 0.339 . . . . 0.0 110.938 -179.942 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.6 165.57 51.86 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.098 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -68.42 -22.69 38.8 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.633 2.222 . . . . 0.0 112.191 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -52.3 -51.09 60.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.853 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 713' ' ' GLU . . . . . 0.402 ' HB2' ' CD1' ' A' ' 709' ' ' LEU . 1.6 mm-40 -57.96 -27.13 63.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.149 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 24.8 m-70 -76.03 -53.8 7.81 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.669 179.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.53 -46.61 88.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.56 -179.44 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 716' ' ' ARG . . . . . 0.4 ' CG ' ' N ' ' A' ' 717' ' ' LEU . 4.7 ptt180 -67.54 -51.57 49.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.797 -179.188 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . 0.4 ' N ' ' CG ' ' A' ' 716' ' ' ARG . 90.8 mt -64.57 -43.61 93.32 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.693 0.282 . . . . 0.0 111.072 -179.57 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -65.75 -54.17 30.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.242 179.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -50.46 -35.62 29.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.373 -179.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 720' ' ' GLU . . . . . 0.412 ' O ' ' HG2' ' A' ' 723' ' ' MET . 9.9 mt-10 -70.8 -55.47 8.49 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.933 0.397 . . . . 0.0 110.992 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 22.0 t -63.63 -55.17 24.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.168 -179.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -53.38 -42.37 66.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.999 -179.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 723' ' ' MET . . . . . 0.412 ' HG2' ' O ' ' A' ' 720' ' ' GLU . 14.1 ptp -68.66 -38.82 80.71 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 120.38 -0.528 . . . . 0.0 109.98 179.563 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -57.77 -35.02 70.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.157 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 725' ' ' LYS . . . . . 0.415 ' HD2' ' CE2' ' A' ' 619' ' ' TRP . 0.7 OUTLIER -86.11 -34.69 20.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.497 -179.654 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 726' ' ' GLU . . . . . 0.414 ' N ' ' HG3' ' A' ' 725' ' ' LYS . 10.3 mt-10 -72.37 -51.67 19.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.901 0.381 . . . . 0.0 111.189 -179.64 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 727' ' ' ILE . . . . . . . . . . . . . 4.2 mp -87.55 11.68 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.647 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 8.5 tp -55.23 -56.22 22.43 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.775 0.322 . . . . 0.0 111.261 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -56.92 -49.05 76.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.266 -179.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.324 -0.846 . . . . 0.0 110.905 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 619' ' ' TRP . . . . . 0.449 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.164 0 CA-C-O 120.584 0.23 . . . . 0.0 111.464 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 118.22 166.45 13.74 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.49 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.31 -39.84 5.05 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.501 2.134 . . . . 0.0 112.363 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -63.78 -36.87 85.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.952 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 623' ' ' VAL . . . . . 0.449 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 48.6 t -68.64 -45.56 81.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.884 179.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 27.7 tp60 -59.65 -36.92 77.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.527 179.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 625' ' ' ARG . . . . . 0.42 ' HD3' ' CE2' ' A' ' 657' ' ' PHE . 0.1 OUTLIER -63.36 -50.79 68.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.509 179.694 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 6.3 tt -67.16 -27.5 67.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.921 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -73.47 -42.97 61.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.287 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.02 -34.92 73.9 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.176 -179.802 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 19.5 mt -68.94 -49.11 66.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.323 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.86 -35.8 81.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.932 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.52 -44.08 92.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.993 0.425 . . . . 0.0 110.702 179.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 632' ' ' HIS . . . . . 0.474 ' CG ' HD12 ' A' ' 709' ' ' LEU . 35.7 t60 -69.64 -41.63 75.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.806 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . 0.416 HD21 ' CD2' ' A' ' 702' ' ' TYR . 42.6 mt -57.14 -49.93 74.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.145 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.32 -43.5 98.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.709 179.793 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.58 -14.1 61.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.33 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -96.5 -8.18 32.76 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 111.649 0.241 . . . . 0.0 111.649 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 115.13 0.43 22.46 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.52 179.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 638' ' ' ILE . . . . . 0.426 HG21 ' CZ ' ' A' ' 702' ' ' TYR . 14.7 mt -109.41 104.93 17.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 120.766 0.317 . . . . 0.0 111.192 -179.494 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 1.3 m -83.28 104.14 13.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.048 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.28 25.96 5.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.818 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -78.06 -33.11 51.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.812 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -59.49 -73.4 0.09 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.84 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 179.13 118.41 0.21 Allowed Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.877 179.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.76 127.75 16.76 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.364 2.042 . . . . 0.0 111.967 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 4.3 tp -142.68 152.54 42.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.407 0.623 . . . . 0.0 111.836 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 646' ' ' ILE . . . . . 0.413 ' CG2' ' HB3' ' A' ' 651' ' ' LEU . 3.0 tt -149.86 133.53 8.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.552 178.772 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 51.59 41.75 50.25 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.223 -0.989 . . . . 0.0 112.222 -179.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.22 5.61 54.58 Favored Glycine 0 CA--C 1.521 0.466 0 C-N-CA 121.065 -0.588 . . . . 0.0 113.971 179.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.8 m -130.89 162.36 29.83 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 117.561 0.681 . . . . 0.0 111.66 -179.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -79.2 144.21 34.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.787 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 651' ' ' LEU . . . . . 0.443 ' HB2' ' CE1' ' A' ' 656' ' ' PHE . 0.0 OUTLIER -135.25 144.98 47.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.098 0.475 . . . . 0.0 111.433 -179.737 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.71 111.15 23.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.821 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -52.23 -43.41 64.27 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.146 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -59.25 -45.6 90.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.206 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 37.2 t -68.9 -33.9 74.53 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.756 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 656' ' ' PHE . . . . . 0.463 ' CE1' HD11 ' A' ' 682' ' ' LEU . 0.8 OUTLIER -68.54 -46.2 70.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.006 179.966 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 657' ' ' PHE . . . . . 0.42 ' CE2' ' HD3' ' A' ' 625' ' ' ARG . 75.7 t80 -60.82 -48.55 81.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.137 -179.816 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.13 -45.52 87.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.262 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.44 -51.0 71.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.547 -179.498 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 660' ' ' ILE . . . . . 0.449 ' CG2' ' HA ' ' A' ' 666' ' ' MET . 53.3 mt -56.75 -44.54 81.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.751 0.31 . . . . 0.0 110.831 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -62.6 -45.13 94.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.786 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -64.48 -14.99 59.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.355 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 1.7 mmm -94.21 28.06 2.64 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.704 0.288 . . . . 0.0 111.214 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 76.03 33.94 48.68 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.641 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 87.23 171.91 47.71 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.535 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 666' ' ' MET . . . . . 0.467 ' HE2' ' CZ ' ' A' ' 699' ' ' TYR . 10.7 tpt -70.73 -26.48 63.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.699 0.285 . . . . 0.0 111.218 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 667' ' ' GLN . . . . . 0.417 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 20.0 pt20 -58.3 -46.49 86.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.067 -179.79 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 668' ' ' GLN . . . . . 0.429 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 7.3 mm-40 -64.9 -52.75 54.77 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.901 0.382 . . . . 0.0 110.971 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 47.5 t -49.13 -55.89 3.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.816 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 670' ' ' THR . . . . . . . . . . . . . 12.6 t -76.23 -47.3 24.44 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -178.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 671' ' ' ASP . . . . . 0.417 ' CB ' ' O ' ' A' ' 667' ' ' GLN . 15.4 t0 -66.54 -51.14 59.76 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -177.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 672' ' ' LEU . . . . . 0.429 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 7.9 mp -76.08 1.93 14.24 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -179.08 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 6.1 tttp 49.87 84.2 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.024 0.44 . . . . 0.0 110.614 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.02 21.63 1.41 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.026 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 675' ' ' TRP . . . . . 0.748 ' HB3' HD22 ' A' ' 695' ' ' LEU . 31.1 m95 -59.16 -31.7 69.22 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.324 0.583 . . . . 0.0 110.219 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -54.56 -42.97 71.61 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.785 -179.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.97 -51.49 11.05 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 120.706 0.289 . . . . 0.0 111.565 -179.327 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.724 HD23 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.72 -42.52 75.41 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.813 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 679' ' ' ALA . . . . . 0.419 ' HB2' ' O ' ' A' ' 675' ' ' TRP . . . -71.64 -33.15 68.68 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 120.84 0.352 . . . . 0.0 110.589 179.037 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.23 -49.32 67.05 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.532 179.601 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 7.0 mtm -64.08 -21.12 66.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.856 179.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 682' ' ' LEU . . . . . 0.499 ' O ' ' HB2' ' A' ' 683' ' ' ARG . 2.9 mm? -78.96 -1.7 36.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.399 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . 0.499 ' HB2' ' O ' ' A' ' 682' ' ' LEU . 13.5 mmm180 73.17 71.7 0.13 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 121.0 0.428 . . . . 0.0 111.39 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 2.7 mp -131.72 140.35 38.01 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.135 179.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -65.1 123.09 11.06 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.518 2.145 . . . . 0.0 112.68 -179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.79 -26.2 64.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.96 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 3.1 p -65.36 -21.6 66.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.095 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -71.8 111.08 6.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.871 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 25.7 mm-40 -71.67 -68.92 0.42 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.093 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -52.94 -19.21 2.42 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.909 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 691' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.4 -34.69 58.68 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.75 0.31 . . . . 0.0 110.726 179.753 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -70.33 -52.94 19.01 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.175 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -69.36 -36.48 76.9 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.357 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 2.0 tmmm? -63.81 -41.28 97.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.135 0.493 . . . . 0.0 110.003 179.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . 0.748 HD22 ' HB3' ' A' ' 675' ' ' TRP . 0.7 OUTLIER -63.37 -44.92 93.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.421 179.533 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . 0.42 ' O ' ' CD1' ' A' ' 699' ' ' TYR . 43.2 mt-30 -55.53 -44.82 77.06 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.744 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -77.34 -29.78 53.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.206 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 698' ' ' ALA . . . . . 0.409 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.12 -39.05 86.57 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.62 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 699' ' ' TYR . . . . . 0.467 ' CZ ' ' HE2' ' A' ' 666' ' ' MET . 1.7 p90 -83.77 -37.49 22.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.017 0.437 . . . . 0.0 110.244 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 700' ' ' CYS . . . . . 0.439 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 1.3 m -59.95 -31.71 70.12 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.485 179.708 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.53 -11.06 32.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.223 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 702' ' ' TYR . . . . . 0.426 ' CZ ' HG21 ' A' ' 638' ' ' ILE . 4.0 m-85 -114.44 -76.56 0.58 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.9 0.381 . . . . 0.0 111.405 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -54.66 -49.85 69.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.733 -179.361 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . 0.453 HD22 ' CE2' ' A' ' 699' ' ' TYR . 0.5 OUTLIER -49.61 -45.45 48.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.851 0.357 . . . . 0.0 111.353 -179.607 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 2.3 m -55.38 -55.27 33.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.731 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 706' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -64.59 -30.42 71.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.018 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -78.6 -18.62 54.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.423 -179.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 1.7 t -93.13 -19.89 21.04 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.785 0.326 . . . . 0.0 110.97 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 709' ' ' LEU . . . . . 0.488 ' HB3' ' HB2' ' A' ' 713' ' ' GLU . 49.6 mt -51.48 141.51 15.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.555 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 710' ' ' SER . . . . . 0.439 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.5 OUTLIER -78.03 167.97 31.39 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.5 179.586 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . 0.439 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 9.2 Cg_endo -52.58 -22.91 18.05 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.517 2.145 . . . . 0.0 112.374 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -75.98 -55.89 5.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.982 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 713' ' ' GLU . . . . . 0.488 ' HB2' ' HB3' ' A' ' 709' ' ' LEU . 2.3 mm-40 -58.54 -27.26 64.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.021 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 8.7 m-70 -75.85 -53.96 7.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.432 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.05 -36.48 83.72 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.148 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.43 -54.36 21.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.827 0.346 . . . . 0.0 111.089 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 83.6 mt -64.42 -40.62 96.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.712 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -67.33 -54.03 24.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.398 179.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt -50.72 -35.01 29.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.315 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 720' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -67.77 -55.61 12.4 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.993 0.425 . . . . 0.0 110.544 179.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 33.2 t -63.75 -54.73 28.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.106 -179.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -49.06 -44.03 41.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.874 -179.31 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 723' ' ' MET . . . . . . . . . . . . . 16.9 ptp -72.77 -39.9 66.4 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.15 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -50.86 -41.83 58.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.64 -179.305 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 725' ' ' LYS . . . . . 0.442 ' HG2' ' CZ2' ' A' ' 619' ' ' TRP . 0.0 OUTLIER -86.08 -36.82 19.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.686 0.279 . . . . 0.0 111.315 -179.751 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -62.48 -53.61 52.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.989 0.423 . . . . 0.0 110.945 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 727' ' ' ILE . . . . . 0.411 ' CG2' ' O ' ' A' ' 727' ' ' ILE . 4.6 mp -88.49 11.57 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.552 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 8.7 tt -56.79 -34.17 67.38 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.774 0.321 . . . . 0.0 110.995 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -90.53 -48.32 7.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.938 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 22.6 mtmt . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.852 -179.966 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 619' ' ' TRP . . . . . 0.442 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.462 0.151 0 CA-C-O 120.674 0.273 . . . . 0.0 111.297 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 123.55 164.96 12.17 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.329 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -65.64 -40.8 16.56 Favored 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 122.453 2.102 . . . . 0.0 112.191 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -59.85 -43.25 94.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.918 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 623' ' ' VAL . . . . . 0.442 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 38.3 t -71.54 -38.05 66.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.913 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -54.3 -45.39 72.54 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.661 179.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 8.3 mtt180 -70.68 -39.77 73.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.343 179.423 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -63.28 -32.27 73.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.768 179.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -72.9 -48.26 38.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.319 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -57.03 -46.56 82.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.951 -179.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 10.4 mt -66.38 -38.95 82.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.929 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 15.5 ttpt -64.22 -39.52 94.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.935 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.13 -42.41 89.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.817 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 632' ' ' HIS . . . . . 0.435 ' CD2' HD13 ' A' ' 709' ' ' LEU . 84.1 t60 -70.52 -41.44 72.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.796 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . 0.415 HD21 ' CD2' ' A' ' 702' ' ' TYR . 49.7 mt -58.27 -49.73 76.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.291 -179.718 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 634' ' ' ARG . . . . . 0.434 ' HG3' ' N ' ' A' ' 635' ' ' SER . 3.8 ptt180 -65.79 -38.77 89.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.983 -179.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 635' ' ' SER . . . . . 0.434 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 0.3 OUTLIER -73.71 -20.38 60.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.091 179.77 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 636' ' ' GLN . . . . . 0.423 ' CG ' ' CE1' ' A' ' 632' ' ' HIS . 32.4 mm-40 -88.93 -5.25 58.11 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.665 -179.661 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 109.97 -0.85 30.09 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.418 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 638' ' ' ILE . . . . . 0.408 HG21 ' CE2' ' A' ' 702' ' ' TYR . 13.9 mt -103.21 104.62 16.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 CA-C-O 120.703 0.287 . . . . 0.0 111.127 -179.612 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.11 108.43 17.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.899 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 1.6 mtp -119.87 28.6 8.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.864 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -60.99 -33.0 72.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.835 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -67.48 -78.62 0.06 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.904 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 178.06 129.81 0.21 Allowed Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.901 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.98 130.86 18.49 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.413 2.075 . . . . 0.0 112.223 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 4.4 tp -124.12 151.78 43.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.272 0.558 . . . . 0.0 111.455 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 646' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -149.66 132.9 7.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.614 178.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.21 40.95 60.69 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.304 -179.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.08 5.43 58.54 Favored Glycine 0 C--N 1.334 0.439 0 C-N-CA 120.989 -0.624 . . . . 0.0 113.875 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -132.26 163.79 27.83 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 117.447 0.624 . . . . 0.0 111.432 -179.115 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -79.29 145.74 33.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.822 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 651' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -135.69 145.05 46.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.11 0.481 . . . . 0.0 111.599 -179.57 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.91 112.33 24.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.97 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 6.7 mp -61.08 -33.78 73.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.076 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -64.58 -47.57 78.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.935 0.398 . . . . 0.0 110.942 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 53.3 t -70.34 -33.07 71.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.271 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 656' ' ' PHE . . . . . 0.46 ' CE2' ' HG ' ' A' ' 682' ' ' LEU . 0.3 OUTLIER -69.1 -46.28 68.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.569 179.624 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -58.17 -52.76 64.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.091 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -57.84 -41.34 82.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.823 0.344 . . . . 0.0 110.789 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.03 -46.0 75.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.124 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 660' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 656' ' ' PHE . 12.6 mt -63.2 -42.33 96.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.045 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -62.21 -46.15 90.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.114 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 71.4 tt0 -72.86 -9.54 58.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.474 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 1.4 mmm -95.03 36.66 1.19 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.765 0.317 . . . . 0.0 111.125 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 66.91 38.43 92.89 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.364 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 79.96 172.23 43.76 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.453 -179.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 666' ' ' MET . . . . . 0.497 ' HE1' ' CE2' ' A' ' 699' ' ' TYR . 9.7 tpt -72.15 -27.19 62.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.654 0.264 . . . . 0.0 111.256 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -57.53 -48.85 78.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.437 -179.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 668' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -63.19 -42.87 99.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.837 0.351 . . . . 0.0 111.296 -179.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 40.2 t -61.81 -53.35 49.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.785 -179.67 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 670' ' ' THR . . . . . 0.415 HG23 ' O ' ' A' ' 666' ' ' MET . 10.1 t -75.75 -49.66 17.53 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -178.615 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 51.2 m-20 -63.09 -51.01 68.28 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -178.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 22.6 mt -87.04 10.87 15.17 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 111.895 0.332 . . . . 0.0 111.895 -179.362 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 10.5 ttpp 46.67 77.19 0.09 Allowed 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 120.929 0.395 . . . . 0.0 110.506 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.52 6.71 14.74 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.706 -179.371 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 675' ' ' TRP . . . . . 0.805 ' HB3' HD11 ' A' ' 695' ' ' LEU . 77.1 m95 -65.05 -22.73 67.02 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.7 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -59.16 -51.68 68.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.845 0.355 . . . . 0.0 111.022 -179.519 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 5.1 tptt -78.0 -47.18 19.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.167 0.508 . . . . 0.0 110.193 179.402 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.655 ' CD2' ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -52.97 -46.41 68.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.176 179.297 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 679' ' ' ALA . . . . . 0.424 ' N ' HD21 ' A' ' 678' ' ' LEU . . . -71.27 -35.68 71.45 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.213 179.769 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -52.87 -48.08 67.37 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.778 0.323 . . . . 0.0 110.863 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 1.8 ttp -65.3 -20.69 66.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.861 179.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 682' ' ' LEU . . . . . 0.46 ' HG ' ' CE2' ' A' ' 656' ' ' PHE . 2.1 mm? -80.06 -3.43 48.54 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.523 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . 0.419 ' HB2' ' O ' ' A' ' 682' ' ' LEU . 0.5 OUTLIER 74.89 71.72 0.1 Allowed 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.936 0.398 . . . . 0.0 111.318 179.874 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . 0.403 HG23 ' HD2' ' A' ' 685' ' ' PRO . 1.8 mp -125.13 138.1 30.98 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.21 179.631 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . 0.403 ' HD2' HG23 ' A' ' 684' ' ' ILE . 41.1 Cg_endo -68.42 121.32 8.26 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.364 2.043 . . . . 0.0 112.567 -179.654 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 3.0 pptp? -69.76 -18.71 63.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.184 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.23 -20.47 66.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.299 -179.766 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 688' ' ' ALA . . . . . 0.412 ' O ' ' HG2' ' A' ' 691' ' ' ARG . . . -65.02 117.65 7.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.899 0.381 . . . . 0.0 110.87 179.778 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.13 7.83 14.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.557 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -138.84 -0.19 1.93 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.442 179.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 691' ' ' ARG . . . . . 0.459 ' O ' ' HB3' ' A' ' 695' ' ' LEU . 2.5 ptt180 -56.48 -33.94 66.45 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.764 0.316 . . . . 0.0 111.068 -179.585 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . 0.434 ' O ' ' CD2' ' A' ' 695' ' ' LEU . 0.5 OUTLIER -70.17 -53.09 18.67 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.927 0.394 . . . . 0.0 110.996 -179.943 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.98 -37.18 69.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.828 0.346 . . . . 0.0 111.565 -179.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.44 -41.29 98.67 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.361 -179.495 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . 0.805 HD11 ' HB3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -72.95 -40.01 65.73 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.969 -0.293 . . . . 0.0 110.654 179.972 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . 0.497 ' O ' ' CD1' ' A' ' 699' ' ' TYR . 0.0 OUTLIER -55.33 -44.6 76.02 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.29 0.567 . . . . 0.0 109.752 179.126 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -77.6 -29.46 51.92 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.754 179.075 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -66.78 -40.68 88.26 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.878 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 699' ' ' TYR . . . . . 0.497 ' CE2' ' HE1' ' A' ' 666' ' ' MET . 2.6 p90 -80.82 -40.4 25.02 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.833 0.349 . . . . 0.0 110.441 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 700' ' ' CYS . . . . . 0.417 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 0.7 OUTLIER -58.86 -33.03 70.0 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.784 179.909 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -94.4 -4.57 48.17 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.68 -179.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 702' ' ' TYR . . . . . 0.415 ' CD2' HD21 ' A' ' 633' ' ' LEU . 8.3 m-85 -123.3 -76.58 0.59 Allowed 'General case' 0 C--O 1.231 0.126 0 CA-C-O 120.791 0.329 . . . . 0.0 111.38 -179.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 25.5 mt -56.31 -45.95 80.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.488 -179.356 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . 0.453 ' CD2' ' CE2' ' A' ' 699' ' ' TYR . 0.4 OUTLIER -47.62 -54.34 12.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.956 0.407 . . . . 0.0 111.284 -179.792 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 705' ' ' SER . . . . . 0.402 ' O ' ' HG ' ' A' ' 709' ' ' LEU . 0.1 OUTLIER -54.57 -48.34 72.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.97 -179.846 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 706' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -64.51 -31.61 72.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.052 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -79.57 -16.28 56.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.306 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -97.44 -19.75 18.22 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.771 0.319 . . . . 0.0 111.13 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 709' ' ' LEU . . . . . 0.435 HD13 ' CD2' ' A' ' 632' ' ' HIS . 45.7 mt -55.31 151.36 9.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.998 0.428 . . . . 0.0 111.466 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 710' ' ' SER . . . . . 0.412 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.3 OUTLIER -80.05 171.73 11.66 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.597 179.753 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . 0.412 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 60.1 Cg_endo -72.38 -6.75 19.67 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.494 2.129 . . . . 0.0 112.862 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -74.57 -56.62 4.63 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.854 0.359 . . . . 0.0 110.943 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 713' ' ' GLU . . . . . 0.419 ' CG ' ' HB3' ' A' ' 709' ' ' LEU . 2.8 pp20? -61.06 -25.79 67.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.033 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -73.23 -54.1 9.26 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.167 179.571 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 26.5 ttt180 -60.13 -40.69 90.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.11 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.47 -53.94 12.28 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.324 -179.702 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 76.8 mt -60.6 -43.26 97.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.863 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -63.86 -54.03 41.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.361 179.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 10.8 mmtt -50.38 -35.07 26.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.292 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 720' ' ' GLU . . . . . 0.413 ' O ' ' HG2' ' A' ' 723' ' ' MET . 1.5 mm-40 -70.39 -55.31 9.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.981 0.419 . . . . 0.0 110.93 179.866 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 39.2 t -63.77 -55.15 24.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.179 -179.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 7.1 mp -53.48 -41.94 66.75 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.1 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 723' ' ' MET . . . . . 0.413 ' HG2' ' O ' ' A' ' 720' ' ' GLU . 5.8 ptp -68.92 -38.83 79.79 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.052 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -59.68 -35.38 74.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.145 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 725' ' ' LYS . . . . . 0.422 ' HD3' ' CE2' ' A' ' 619' ' ' TRP . 10.0 pttt -86.15 -37.8 18.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.433 -179.663 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 726' ' ' GLU . . . . . 0.401 ' N ' ' HG3' ' A' ' 725' ' ' LYS . 3.5 mm-40 -70.11 -50.42 40.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.308 -179.524 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 727' ' ' ILE . . . . . 0.401 ' O ' ' CG2' ' A' ' 727' ' ' ILE . 4.1 mp -88.09 11.64 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.697 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 2.8 tt -57.68 -35.73 70.97 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.835 0.35 . . . . 0.0 110.952 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -63.04 -51.52 66.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.994 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 3.6 mtpt . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.18 -0.914 . . . . 0.0 110.927 -179.941 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 619' ' ' TRP . . . . . 0.481 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.462 0.172 0 CA-C-O 120.705 0.288 . . . . 0.0 111.275 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 126.99 169.49 12.72 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.424 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -69.19 -33.65 18.27 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.589 2.193 . . . . 0.0 112.195 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -68.25 -43.34 78.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.849 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 623' ' ' VAL . . . . . 0.481 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 38.6 t -71.85 -39.58 67.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.897 179.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 1.9 tm0? -56.55 -50.39 72.03 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.868 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 6.9 mmm180 -64.44 -43.39 94.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.769 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 4.1 tt -59.65 -36.93 77.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.046 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -72.36 -45.8 58.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.365 -179.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.1 -47.11 81.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.167 -179.77 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 8.5 mt -65.74 -42.49 92.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.098 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.75 -45.16 91.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.169 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 2.1 tttp -59.8 -43.86 94.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.19 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 632' ' ' HIS . . . . . 0.444 ' CD2' ' HA ' ' A' ' 706' ' ' TYR . 86.3 t60 -68.91 -40.89 78.86 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.119 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 46.2 mt -57.49 -47.46 81.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.171 -179.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -64.14 -43.25 95.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.827 0.346 . . . . 0.0 110.605 179.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 20.2 m -73.67 -11.74 60.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.303 179.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 32.2 mm-40 -97.46 -9.6 26.93 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.654 -179.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 118.57 -8.7 13.25 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.268 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 638' ' ' ILE . . . . . 0.437 HG22 ' CE2' ' A' ' 702' ' ' TYR . 10.4 mt -100.57 104.64 16.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.649 0.261 . . . . 0.0 111.001 -179.78 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.82 109.49 15.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.086 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 1.6 mtm -113.64 25.15 11.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.82 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.98 -47.76 49.82 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.865 -179.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -49.59 -72.6 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.096 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -178.05 117.66 0.25 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.821 179.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -67.97 119.82 6.83 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.393 2.062 . . . . 0.0 112.097 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 4.4 tp -131.15 154.96 47.8 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.402 0.62 . . . . 0.0 111.651 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 646' ' ' ILE . . . . . 0.409 ' CG2' ' HB3' ' A' ' 651' ' ' LEU . 2.3 tt -149.94 134.2 8.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.54 178.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 50.14 41.65 38.9 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.214 -0.993 . . . . 0.0 112.12 -179.343 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.16 5.74 54.74 Favored Glycine 0 CA--C 1.522 0.507 0 C-N-CA 121.025 -0.607 . . . . 0.0 113.812 179.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -131.82 162.54 30.32 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 117.553 0.677 . . . . 0.0 111.541 -179.089 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -81.38 144.33 31.52 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.85 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 651' ' ' LEU . . . . . 0.409 ' HB3' ' CG2' ' A' ' 646' ' ' ILE . 0.0 OUTLIER -134.78 145.07 48.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.191 179.988 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -95.27 110.41 22.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.883 -179.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -52.85 -36.07 58.35 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.025 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -69.31 -47.09 65.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.042 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 19.3 t -65.91 -41.78 91.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.629 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 656' ' ' PHE . . . . . 0.414 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.1 OUTLIER -67.37 -44.13 79.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.739 179.805 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -56.52 -51.71 67.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.885 179.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 11.2 ttt180 -58.58 -40.85 84.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.773 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.61 -45.62 77.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.102 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 660' ' ' ILE . . . . . 0.462 ' CG2' ' HA ' ' A' ' 666' ' ' MET . 33.0 mt -66.11 -44.27 91.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.265 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -61.25 -41.51 97.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.386 -179.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -72.3 -10.34 59.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.61 -179.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.74 36.58 1.38 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.76 0.314 . . . . 0.0 111.186 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 68.63 28.81 72.91 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.628 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 92.32 171.37 41.26 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.593 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 666' ' ' MET . . . . . 0.511 ' HE1' ' CZ ' ' A' ' 699' ' ' TYR . 10.6 tpt -71.59 -30.87 66.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.758 0.313 . . . . 0.0 111.254 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 667' ' ' GLN . . . . . 0.405 ' O ' ' HB2' ' A' ' 671' ' ' ASP . 7.4 pt20 -55.15 -44.92 75.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.139 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 668' ' ' GLN . . . . . 0.411 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -65.23 -52.19 56.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.898 0.38 . . . . 0.0 110.942 179.922 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 48.7 t -49.02 -54.75 4.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.592 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 670' ' ' THR . . . . . . . . . . . . . 12.9 t -76.22 -50.68 13.83 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 -178.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 671' ' ' ASP . . . . . 0.405 ' HB2' ' O ' ' A' ' 667' ' ' GLN . 70.0 m-20 -61.18 -51.18 70.09 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -177.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 672' ' ' LEU . . . . . 0.411 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 10.4 mp -76.22 1.62 15.42 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -178.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 2.9 mmmt 50.14 85.19 0.03 OUTLIER 'General case' 0 C--O 1.232 0.138 0 CA-C-O 121.042 0.448 . . . . 0.0 110.387 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 7.4 mtmt -147.88 19.88 1.14 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.209 -179.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 675' ' ' TRP . . . . . 0.705 ' HB3' HD23 ' A' ' 695' ' ' LEU . 26.4 m95 -55.77 -29.24 59.31 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-O 121.428 0.632 . . . . 0.0 110.199 179.816 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -57.34 -42.9 82.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.684 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 11.1 mmtp -76.32 -51.83 11.18 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 111.668 0.248 . . . . 0.0 111.668 -179.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.688 HD23 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -57.32 -41.3 79.68 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 179.528 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 679' ' ' ALA . . . . . 0.403 ' O ' ' HB2' ' A' ' 682' ' ' LEU . . . -71.72 -30.01 65.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.208 178.779 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.44 -51.56 66.53 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.295 179.57 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -60.53 -22.5 63.68 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.644 179.405 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 682' ' ' LEU . . . . . 0.403 ' HB2' ' O ' ' A' ' 679' ' ' ALA . 2.5 mm? -78.89 -2.2 38.74 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.445 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . 0.4 ' HB2' ' O ' ' A' ' 682' ' ' LEU . 1.1 mmt180 71.88 71.85 0.16 Allowed 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.962 0.41 . . . . 0.0 110.867 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . 0.43 HG23 ' HD2' ' A' ' 685' ' ' PRO . 1.7 mp -122.56 135.76 25.96 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.927 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . 0.43 ' HD2' HG23 ' A' ' 684' ' ' ILE . 37.4 Cg_endo -66.29 122.59 10.11 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.418 2.078 . . . . 0.0 112.3 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 1.5 mmtm -70.0 -17.28 63.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.245 179.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 1.1 p -65.46 -22.81 66.79 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.321 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -84.58 105.18 15.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.871 0.367 . . . . 0.0 110.905 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 -70.49 -68.46 0.43 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.181 -179.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -52.76 -19.55 2.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.871 -179.583 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 691' ' ' ARG . . . . . 0.418 ' NH2' ' CG1' ' A' ' 684' ' ' ILE . 0.0 OUTLIER -48.09 -37.1 14.45 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.856 0.36 . . . . 0.0 111.171 179.922 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -64.23 -42.97 96.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.006 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.05 -36.78 69.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.971 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 3.5 tttt -65.67 -41.69 92.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.128 179.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . 0.705 HD23 ' HB3' ' A' ' 675' ' ' TRP . 0.2 OUTLIER -64.59 -41.93 95.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.279 179.51 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . 0.461 ' O ' ' CD1' ' A' ' 699' ' ' TYR . 0.0 OUTLIER -57.85 -44.16 86.36 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.663 179.706 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -77.37 -29.79 53.47 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.128 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 698' ' ' ALA . . . . . 0.437 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.39 -37.68 83.49 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.716 -179.7 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 699' ' ' TYR . . . . . 0.511 ' CZ ' ' HE1' ' A' ' 666' ' ' MET . 2.1 p90 -84.26 -39.06 19.73 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.945 0.402 . . . . 0.0 110.305 179.689 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 700' ' ' CYS . . . . . . . . . . . . . 13.7 t -60.03 -30.54 69.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.567 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -97.89 -3.49 38.49 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.451 179.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 702' ' ' TYR . . . . . 0.437 ' CE2' HG22 ' A' ' 638' ' ' ILE . 5.3 m-85 -117.98 -74.94 0.59 Allowed 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.862 0.363 . . . . 0.0 111.278 -179.719 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 1.1 mp -60.91 -46.8 89.21 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.677 -179.263 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -52.76 -50.76 62.86 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.925 0.393 . . . . 0.0 111.072 -179.812 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 705' ' ' SER . . . . . 0.462 ' O ' HD11 ' A' ' 709' ' ' LEU . 0.3 OUTLIER -54.6 -54.84 36.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.719 179.935 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 706' ' ' TYR . . . . . 0.497 ' CE2' ' CE1' ' A' ' 714' ' ' HIS . 23.8 t80 -47.18 -43.12 20.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.97 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -93.79 -0.82 55.67 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.06 -16.43 56.8 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.453 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 709' ' ' LEU . . . . . 0.462 HD11 ' O ' ' A' ' 705' ' ' SER . 0.0 OUTLIER -95.71 -173.35 2.84 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.833 0.349 . . . . 0.0 111.51 -179.642 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 710' ' ' SER . . . . . 0.408 ' O ' HD22 ' A' ' 709' ' ' LEU . 0.3 OUTLIER -86.71 165.47 32.35 Favored Pre-proline 0 C--N 1.332 -0.158 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.192 -179.705 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo -56.87 -18.78 28.93 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.772 2.315 . . . . 0.0 112.972 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -60.04 -54.16 49.24 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.93 0.395 . . . . 0.0 110.81 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 713' ' ' GLU . . . . . 0.431 ' HB2' ' HG ' ' A' ' 709' ' ' LEU . 2.7 mm-40 -61.28 -25.93 67.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.932 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 714' ' ' HIS . . . . . 0.497 ' CE1' ' CE2' ' A' ' 706' ' ' TYR . 0.2 OUTLIER -75.59 -54.06 7.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.254 179.529 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 22.5 ttt85 -66.22 -34.12 77.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.202 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 3.0 ttt180 -67.79 -54.28 20.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.841 0.353 . . . . 0.0 110.983 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 29.7 mt -64.62 -34.98 79.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.449 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -69.81 -53.81 16.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.405 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.48 -33.41 54.19 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.562 -179.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 720' ' ' GLU . . . . . 0.425 ' O ' ' HG2' ' A' ' 723' ' ' MET . 13.8 mt-10 -70.56 -55.73 8.18 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.036 0.446 . . . . 0.0 110.498 179.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 41.4 t -61.66 -51.58 71.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.013 -179.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 9.0 mp -56.47 -38.56 71.87 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.921 -179.188 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 723' ' ' MET . . . . . 0.425 ' HG2' ' O ' ' A' ' 720' ' ' GLU . 16.1 ptp -74.67 -41.34 60.46 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.954 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 724' ' ' GLU . . . . . 0.418 ' N ' ' HG3' ' A' ' 723' ' ' MET . 1.6 mm-40 -56.87 -30.65 64.06 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.156 -179.846 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 725' ' ' LYS . . . . . 0.425 ' HD3' ' CZ2' ' A' ' 619' ' ' TRP . 15.0 pttt -86.19 -43.52 12.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.256 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -66.38 -51.55 55.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.082 -179.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 727' ' ' ILE . . . . . . . . . . . . . 3.9 mp -87.83 11.66 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.667 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 5.4 tt -52.64 -34.0 49.4 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.829 0.347 . . . . 0.0 111.142 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -83.57 -55.59 4.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.891 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 27.3 mtmm . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.27 -0.871 . . . . 0.0 110.932 -179.961 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 619' ' ' TRP . . . . . 0.463 ' CH2' ' HB3' ' A' ' 725' ' ' LYS . 0.1 OUTLIER . . . . . 0 CA--C 1.528 0.132 0 CA-C-O 120.618 0.246 . . . . 0.0 111.443 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 119.93 161.72 11.65 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.385 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -68.22 -36.19 17.16 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.499 2.133 . . . . 0.0 112.264 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -67.56 -35.86 79.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.856 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 623' ' ' VAL . . . . . 0.445 HG12 ' CD2' ' A' ' 619' ' ' TRP . 40.6 t -70.44 -38.48 74.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.618 179.527 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 24.6 tp60 -68.17 -34.76 76.9 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.332 179.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.21 -50.71 69.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.33 179.511 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 8.5 tt -67.35 -33.52 75.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.711 179.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -69.09 -46.87 66.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.209 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -59.07 -49.18 78.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.073 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 7.3 mt -62.97 -35.46 71.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.109 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 5.7 ttpt -63.21 -47.85 80.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.069 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.31 -39.25 92.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.08 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 632' ' ' HIS . . . . . 0.44 ' CD2' ' HA ' ' A' ' 706' ' ' TYR . 78.5 t60 -70.73 -42.58 70.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.161 -179.876 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . 0.419 HD11 ' CD2' ' A' ' 702' ' ' TYR . 15.4 mt -58.13 -50.07 74.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.349 -179.559 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.62 -42.36 98.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.796 0.331 . . . . 0.0 110.671 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -73.59 -11.5 60.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.066 179.457 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 636' ' ' GLN . . . . . 0.4 ' CG ' ' CE1' ' A' ' 632' ' ' HIS . 15.6 mm-40 -98.62 -9.32 24.93 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.573 -179.799 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 119.06 -9.04 12.28 Favored Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.467 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 638' ' ' ILE . . . . . 0.447 HG22 ' CZ ' ' A' ' 702' ' ' TYR . 3.5 mp -100.69 104.65 16.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.748 0.309 . . . . 0.0 111.112 -179.62 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 2.4 m -76.68 113.44 14.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.89 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 1.9 mtp -129.09 31.7 4.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.97 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.55 -28.53 69.93 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.043 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -79.86 -80.13 0.13 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.041 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -177.54 140.14 0.43 Allowed Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.876 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -77.02 147.36 26.61 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.588 2.192 . . . . 0.0 112.481 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 5.1 tp -136.04 150.51 49.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.131 0.491 . . . . 0.0 110.965 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 646' ' ' ILE . . . . . 0.405 ' CG2' ' HB3' ' A' ' 651' ' ' LEU . 0.6 OUTLIER -147.85 132.19 9.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.701 179.249 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.31 41.79 62.86 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.317 -0.944 . . . . 0.0 112.345 -179.367 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 69.52 7.49 58.09 Favored Glycine 0 C--N 1.332 0.348 0 C-N-CA 121.0 -0.619 . . . . 0.0 113.779 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.7 m -132.97 163.76 28.48 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 117.358 0.579 . . . . 0.0 111.434 -179.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -79.66 144.54 33.65 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.708 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 651' ' ' LEU . . . . . 0.405 ' HB3' ' CG2' ' A' ' 646' ' ' ILE . 0.0 OUTLIER -135.11 144.93 47.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.125 0.488 . . . . 0.0 111.357 -179.661 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.9 107.26 19.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.856 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 7.2 mp -55.03 -40.21 69.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.959 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -59.19 -43.45 92.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.98 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 5.6 t -72.16 -43.03 65.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.613 179.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 656' ' ' PHE . . . . . 0.427 ' CE2' ' HG ' ' A' ' 682' ' ' LEU . 0.3 OUTLIER -60.45 -46.37 90.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.754 179.801 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -60.6 -49.5 77.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.936 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.1 -43.22 99.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.946 -179.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.55 -39.85 77.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.161 -179.87 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 660' ' ' ILE . . . . . 0.43 HG12 ' CD1' ' A' ' 678' ' ' LEU . 83.1 mt -69.01 -43.71 81.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.785 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.35 -43.35 94.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.051 -179.809 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -69.81 -13.73 62.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.355 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 1.2 ttm -94.27 21.18 7.24 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.29 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 95.44 -2.77 65.45 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.61 -0.805 . . . . 0.0 113.124 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 116.06 178.47 18.26 Favored Glycine 0 C--N 1.332 0.314 0 C-N-CA 120.539 -0.839 . . . . 0.0 112.446 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 666' ' ' MET . . . . . 0.427 ' HG2' ' CG2' ' A' ' 660' ' ' ILE . 0.0 OUTLIER -71.55 -30.85 66.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.862 0.363 . . . . 0.0 110.911 179.896 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 667' ' ' GLN . . . . . 0.401 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 19.0 pt20 -57.79 -48.74 78.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.458 -179.725 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 668' ' ' GLN . . . . . 0.409 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 8.9 mm-40 -62.37 -52.41 63.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.864 0.364 . . . . 0.0 111.334 -179.637 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 669' ' ' VAL . . . . . 0.405 HG12 ' CD1' ' A' ' 675' ' ' TRP . 73.4 t -51.4 -55.78 7.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.936 -179.646 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 670' ' ' THR . . . . . . . . . . . . . 8.0 t -76.09 -50.03 15.83 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 -178.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 671' ' ' ASP . . . . . 0.401 ' CB ' ' O ' ' A' ' 667' ' ' GLN . 5.7 t70 -61.6 -51.15 69.72 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -177.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 672' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 8.8 mp -78.59 2.7 18.42 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 -178.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 48.77 86.6 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.994 0.426 . . . . 0.0 110.485 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -149.15 21.75 0.96 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.077 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 675' ' ' TRP . . . . . 0.777 ' CE3' HD23 ' A' ' 678' ' ' LEU . 36.2 m95 -59.02 -27.98 65.98 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.447 0.641 . . . . 0.0 110.093 179.706 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -56.54 -42.79 79.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.542 -179.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.58 -51.62 11.28 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.784 0.326 . . . . 0.0 111.419 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.777 HD23 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.49 -39.73 70.8 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 179.693 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 679' ' ' ALA . . . . . 0.414 ' N ' ' CD2' ' A' ' 678' ' ' LEU . . . -71.94 -34.65 69.2 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.507 179.154 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -53.24 -48.5 68.16 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.433 179.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.14 -21.42 66.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.769 179.37 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 682' ' ' LEU . . . . . 0.452 ' O ' ' HB2' ' A' ' 683' ' ' ARG . 3.6 mm? -78.9 -1.41 35.0 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.496 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . 0.452 ' HB2' ' O ' ' A' ' 682' ' ' LEU . 3.5 mpt_? 68.5 71.81 0.29 Allowed 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.94 0.4 . . . . 0.0 111.489 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . 0.405 HG23 ' HD2' ' A' ' 685' ' ' PRO . 1.9 mp -123.97 136.02 26.99 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.273 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . 0.405 ' HD2' HG23 ' A' ' 684' ' ' ILE . 29.1 Cg_endo -63.25 125.33 15.52 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.418 2.079 . . . . 0.0 112.414 -179.779 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.77 -16.05 63.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.102 179.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.57 -23.95 66.97 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.216 -179.787 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 688' ' ' ALA . . . . . 0.443 ' CB ' ' HB3' ' A' ' 691' ' ' ARG . . . -77.84 115.68 17.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.859 0.361 . . . . 0.0 110.769 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -76.18 -68.24 0.6 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.376 -179.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 56.9 m-20 -57.76 -11.67 2.41 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 691' ' ' ARG . . . . . 0.443 ' HB3' ' CB ' ' A' ' 688' ' ' ALA . 4.9 ptt-85 -50.32 -32.44 17.12 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.791 0.329 . . . . 0.0 111.049 -179.843 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . 0.41 HD23 ' CG ' ' A' ' 691' ' ' ARG . 2.9 mm? -68.17 -50.39 54.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.925 -179.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.03 -37.31 69.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.039 179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 1.3 mtpt -63.28 -37.83 88.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.243 179.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . 0.768 HD23 ' HB3' ' A' ' 675' ' ' TRP . 0.5 OUTLIER -68.77 -44.26 74.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.484 179.74 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . 0.435 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 31.8 tt0 -55.37 -47.7 75.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.748 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 71.1 mt-10 -77.11 -29.61 54.91 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.834 179.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 698' ' ' ALA . . . . . 0.405 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -66.46 -38.03 86.44 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.46 -179.901 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 699' ' ' TYR . . . . . 0.499 ' CD2' ' CZ2' ' A' ' 675' ' ' TRP . 1.0 OUTLIER -85.92 -30.53 22.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.893 0.378 . . . . 0.0 110.496 179.862 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 700' ' ' CYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 15.4 t -66.84 -30.51 70.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.644 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -99.49 -2.32 36.24 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.478 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 702' ' ' TYR . . . . . 0.447 ' CZ ' HG22 ' A' ' 638' ' ' ILE . 6.2 m-85 -117.68 -78.27 0.58 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.802 0.334 . . . . 0.0 111.214 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 75.7 mt -57.71 -43.74 85.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.464 -179.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . 0.435 HD23 ' CE1' ' A' ' 699' ' ' TYR . 0.6 OUTLIER -55.08 -52.22 63.89 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.881 0.372 . . . . 0.0 111.008 -179.921 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 705' ' ' SER . . . . . 0.47 ' O ' HD13 ' A' ' 709' ' ' LEU . 59.7 p -54.37 -55.0 32.98 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.665 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 706' ' ' TYR . . . . . 0.44 ' HA ' ' CD2' ' A' ' 632' ' ' HIS . 9.7 t80 -46.9 -43.07 18.57 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.845 -179.571 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -94.03 0.02 55.72 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -179.48 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 22.6 t -79.19 -18.47 52.94 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -179.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 709' ' ' LEU . . . . . 0.47 HD13 ' O ' ' A' ' 705' ' ' SER . 0.0 OUTLIER -94.16 -173.92 3.23 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.831 0.348 . . . . 0.0 111.406 -179.815 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 710' ' ' SER . . . . . 0.4 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.3 OUTLIER -85.45 165.97 33.0 Favored Pre-proline 0 C--N 1.332 -0.181 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.048 -179.804 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . 0.4 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 18.0 Cg_endo -57.89 -18.93 37.12 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.625 2.217 . . . . 0.0 112.734 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -60.91 -54.27 47.06 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.913 0.387 . . . . 0.0 110.72 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 713' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -60.41 -26.06 66.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.832 179.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 714' ' ' HIS . . . . . 0.437 ' CE1' ' CZ ' ' A' ' 706' ' ' TYR . 1.3 m-70 -75.61 -53.86 7.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.114 179.255 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 6.2 mmm180 -64.65 -33.02 74.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.07 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 3.3 mtt180 -67.47 -54.28 21.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.867 0.365 . . . . 0.0 110.805 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 25.9 mt -64.12 -37.47 87.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.478 179.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -67.63 -53.92 23.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.357 179.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.3 -34.76 48.16 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.497 -179.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 720' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -67.69 -55.85 11.62 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.06 0.457 . . . . 0.0 110.279 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 44.2 t -60.78 -50.96 78.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.638 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -48.79 -46.39 41.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.907 -179.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 723' ' ' MET . . . . . . . . . . . . . 18.0 ptp -73.99 -40.77 62.72 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.098 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -50.76 -41.53 56.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.759 -179.199 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 725' ' ' LYS . . . . . 0.463 ' HB3' ' CH2' ' A' ' 619' ' ' TRP . 0.0 OUTLIER -83.23 -40.2 19.93 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.65 0.262 . . . . 0.0 111.271 -179.687 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -60.56 -52.99 62.84 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.968 0.413 . . . . 0.0 110.836 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 727' ' ' ILE . . . . . . . . . . . . . 4.2 mp -89.82 11.62 2.0 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.558 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 6.6 tt -53.87 -42.47 68.64 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.847 0.356 . . . . 0.0 111.152 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -71.98 -70.64 0.32 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.962 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.96 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 619' ' ' TRP . . . . . 0.419 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.1 OUTLIER . . . . . 0 CA--C 1.528 0.126 0 CA-C-O 120.627 0.251 . . . . 0.0 111.439 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 118.53 161.32 11.78 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.373 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -67.47 -39.81 11.76 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.497 2.131 . . . . 0.0 112.332 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -65.08 -35.97 82.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.941 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 623' ' ' VAL . . . . . 0.419 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 42.1 t -67.81 -43.62 86.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.751 179.686 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 40.9 tp60 -59.49 -42.68 92.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.526 179.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -58.66 -50.75 72.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.429 179.596 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 6.6 tt -65.7 -28.31 68.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.79 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -71.4 -52.56 17.89 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.587 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 29.5 p -60.84 -38.63 86.18 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.396 -179.533 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 51.3 mt -66.72 -45.54 87.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.329 -179.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 43.8 pttt -66.24 -33.89 76.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.722 0.296 . . . . 0.0 110.987 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 2.0 tttm -67.35 -46.8 72.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.014 0.435 . . . . 0.0 110.79 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 632' ' ' HIS . . . . . 0.449 ' CE1' ' CD1' ' A' ' 709' ' ' LEU . 86.6 t60 -67.28 -39.61 86.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.734 179.77 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 21.8 mt -57.82 -48.99 78.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.047 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 634' ' ' ARG . . . . . 0.415 ' HG3' ' N ' ' A' ' 635' ' ' SER . 0.1 OUTLIER -63.16 -40.6 98.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.831 179.974 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 635' ' ' SER . . . . . 0.415 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 1.6 m -73.68 -19.93 60.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.219 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -90.58 -7.45 52.79 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.677 -179.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 117.92 -13.12 12.98 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.478 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 638' ' ' ILE . . . . . 0.447 HG22 ' CZ ' ' A' ' 702' ' ' TYR . 2.8 mp -94.38 104.59 15.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 120.608 0.242 . . . . 0.0 111.219 -179.716 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -77.56 121.34 23.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.837 0.351 . . . . 0.0 111.007 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 1.9 ttp -133.02 30.19 4.0 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.882 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -65.56 -33.99 77.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.872 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -69.59 -77.39 0.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.846 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 1.4 pp -179.98 136.68 0.28 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.873 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.81 121.01 7.0 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.499 2.132 . . . . 0.0 112.168 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 5.0 tp -119.88 149.52 41.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.221 0.534 . . . . 0.0 111.287 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 646' ' ' ILE . . . . . 0.409 ' CG2' ' HB3' ' A' ' 651' ' ' LEU . 1.2 tt -144.83 130.15 14.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.45 178.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 647' ' ' GLY . . . . . 0.408 ' O ' ' NH1' ' A' ' 691' ' ' ARG . . . 51.91 47.0 54.82 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.269 -0.967 . . . . 0.0 112.086 -179.157 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 64.79 7.67 30.2 Favored Glycine 0 CA--C 1.521 0.421 0 C-N-CA 121.034 -0.603 . . . . 0.0 113.899 179.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 98.7 m -129.73 161.7 30.08 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 117.592 0.696 . . . . 0.0 111.516 -179.21 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -81.19 142.55 33.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.638 179.659 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 651' ' ' LEU . . . . . 0.409 ' HB3' ' CG2' ' A' ' 646' ' ' ILE . 0.0 OUTLIER -134.9 144.72 47.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.041 0.448 . . . . 0.0 111.309 -179.737 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -94.16 109.18 20.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.782 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 6.3 mp -56.67 -35.41 68.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.867 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -65.09 -46.81 79.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.958 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 46.9 t -70.58 -32.66 70.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.562 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 656' ' ' PHE . . . . . 0.473 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.2 OUTLIER -70.55 -46.07 64.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.81 179.881 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -60.14 -49.98 75.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.933 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -58.23 -43.99 88.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.963 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.49 -48.01 80.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.253 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 660' ' ' ILE . . . . . 0.523 ' CG2' ' HA ' ' A' ' 666' ' ' MET . 23.3 mt -56.85 -45.73 83.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.916 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -64.68 -47.19 79.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.029 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -62.38 -16.75 56.51 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.441 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -94.25 31.86 1.63 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.67 0.272 . . . . 0.0 111.295 -179.826 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 76.15 42.37 24.24 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.824 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 78.21 172.76 40.55 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.707 179.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 666' ' ' MET . . . . . 0.523 ' HA ' ' CG2' ' A' ' 660' ' ' ILE . 0.0 OUTLIER -73.13 -33.66 65.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.769 0.319 . . . . 0.0 111.322 179.963 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 16.0 pt20 -53.05 -43.76 66.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.322 -179.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 668' ' ' GLN . . . . . 0.446 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -64.66 -52.48 57.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.972 0.415 . . . . 0.0 110.707 -179.968 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 669' ' ' VAL . . . . . 0.417 ' HB ' ' HE1' ' A' ' 666' ' ' MET . 90.6 t -49.28 -55.52 4.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.567 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 670' ' ' THR . . . . . 0.439 ' HB ' ' CE ' ' A' ' 666' ' ' MET . 8.8 t -76.19 -51.47 12.05 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -178.467 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -63.72 -51.3 65.59 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -177.658 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 672' ' ' LEU . . . . . 0.446 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 9.3 mp -77.3 3.34 13.23 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -179.039 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 49.02 86.35 0.03 OUTLIER 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.966 0.412 . . . . 0.0 110.509 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 21.0 mttt -146.2 21.91 1.37 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.261 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 675' ' ' TRP . . . . . 0.781 ' CE3' HD21 ' A' ' 678' ' ' LEU . 42.5 m95 -60.91 -28.57 69.02 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 121.401 0.619 . . . . 0.0 110.167 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -55.76 -43.84 77.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.534 -179.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 2.7 ttmm -77.09 -51.53 10.88 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 120.769 0.318 . . . . 0.0 111.4 -179.49 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.781 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -54.92 -41.25 70.75 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 179.65 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 679' ' ' ALA . . . . . 0.409 ' N ' ' CD2' ' A' ' 678' ' ' LEU . . . -71.78 -34.51 69.48 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.766 179.283 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -53.17 -47.67 68.61 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.394 179.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 20.1 mtm -64.67 -21.57 66.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.764 179.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 682' ' ' LEU . . . . . 0.499 ' O ' ' HB2' ' A' ' 683' ' ' ARG . 3.2 mm? -80.11 -2.08 42.94 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.464 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . 0.499 ' HB2' ' O ' ' A' ' 682' ' ' LEU . 0.2 OUTLIER 72.34 71.76 0.15 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.925 0.393 . . . . 0.0 111.7 179.81 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . 0.441 HG23 ' HD2' ' A' ' 685' ' ' PRO . 2.1 mp -129.22 139.95 37.2 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.062 179.406 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . 0.441 ' HD2' HG23 ' A' ' 684' ' ' ILE . 41.0 Cg_endo -66.83 124.81 12.79 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.303 2.002 . . . . 0.0 112.381 -179.745 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -19.18 63.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.19 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.34 -18.81 65.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.384 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 688' ' ' ALA . . . . . 0.43 ' CB ' ' NE ' ' A' ' 691' ' ' ARG . . . -84.47 107.08 16.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.863 0.363 . . . . 0.0 111.056 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -70.82 -67.77 0.48 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.06 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 45.1 m-20 -48.96 -20.93 0.57 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.972 -179.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 691' ' ' ARG . . . . . 0.43 ' NE ' ' CB ' ' A' ' 688' ' ' ALA . 1.4 ttm180 -46.37 -40.35 11.83 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.803 0.335 . . . . 0.0 111.297 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -63.15 -46.46 87.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.183 -179.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.15 -38.67 69.13 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.774 0.321 . . . . 0.0 111.233 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 16.4 mmtt -63.54 -42.19 98.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.989 0.424 . . . . 0.0 110.339 179.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . 0.747 HD23 ' HB3' ' A' ' 675' ' ' TRP . 0.2 OUTLIER -66.84 -40.67 88.04 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.404 179.646 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . 0.425 ' O ' ' CD2' ' A' ' 699' ' ' TYR . 8.9 mt-30 -57.74 -44.98 86.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.788 179.733 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -77.31 -29.81 53.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.203 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 698' ' ' ALA . . . . . 0.4 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.28 -38.36 84.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.653 -179.704 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 699' ' ' TYR . . . . . 0.523 ' CZ ' ' HE2' ' A' ' 666' ' ' MET . 1.8 p90 -83.65 -37.23 23.1 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.864 0.364 . . . . 0.0 110.484 179.875 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 700' ' ' CYS . . . . . 0.435 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 6.8 t -62.18 -30.64 71.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.553 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -95.83 -3.49 45.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.32 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 702' ' ' TYR . . . . . 0.447 ' CZ ' HG22 ' A' ' 638' ' ' ILE . 10.1 m-85 -118.46 -78.53 0.58 Allowed 'General case' 0 CA--C 1.529 0.14 0 CA-C-O 120.849 0.356 . . . . 0.0 111.59 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 23.2 mt -60.22 -43.85 95.68 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.966 -179.069 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . 0.454 HD22 ' CE1' ' A' ' 699' ' ' TYR . 0.4 OUTLIER -47.9 -56.65 7.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.82 0.343 . . . . 0.0 111.647 -179.442 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 42.3 p -54.4 -48.57 71.43 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.405 -179.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 706' ' ' TYR . . . . . . . . . . . . . 57.3 t80 -65.51 -29.21 69.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.529 -179.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -96.95 0.64 49.24 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -179.438 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 39.8 t -115.54 -12.77 11.6 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 111.771 0.285 . . . . 0.0 111.771 -179.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 709' ' ' LEU . . . . . 0.449 ' CD1' ' CE1' ' A' ' 632' ' ' HIS . 0.3 OUTLIER -79.71 179.46 7.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.743 0.306 . . . . 0.0 111.04 -179.969 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -75.04 164.45 61.28 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.143 -179.85 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -68.87 -25.94 32.41 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.645 2.23 . . . . 0.0 112.203 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -50.55 -49.83 55.04 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.748 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 713' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -59.89 -27.24 66.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.024 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 714' ' ' HIS . . . . . 0.413 ' CD2' HD21 ' A' ' 709' ' ' LEU . 12.8 m170 -76.14 -54.03 7.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.501 179.484 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.16 -44.25 97.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.437 -179.614 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 20.8 mtp85 -66.19 -54.18 28.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.223 -179.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 53.1 mt -62.64 -39.54 94.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.674 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -67.33 -54.03 24.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.33 179.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -50.53 -34.7 26.39 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.337 -179.791 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 720' ' ' GLU . . . . . 0.401 ' O ' ' HG2' ' A' ' 723' ' ' MET . 0.5 OUTLIER -69.39 -55.43 10.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.005 0.431 . . . . 0.0 110.561 179.626 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 16.8 t -62.03 -54.94 27.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.156 -179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 1.2 mp -50.51 -44.18 56.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.009 -179.266 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 723' ' ' MET . . . . . 0.401 ' HG2' ' O ' ' A' ' 720' ' ' GLU . 16.9 ptp -71.44 -40.31 70.47 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.496 -0.481 . . . . 0.0 110.024 179.719 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -57.49 -31.58 66.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.381 -179.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 725' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.14 -43.14 13.28 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.404 -179.67 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -66.52 -48.93 68.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.834 0.349 . . . . 0.0 111.193 -179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 727' ' ' ILE . . . . . 0.402 ' O ' ' CG2' ' A' ' 727' ' ' ILE . 3.9 mp -88.96 11.67 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.534 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 5.6 tt -57.38 -36.41 71.21 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.789 0.328 . . . . 0.0 111.028 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -64.57 -68.65 0.34 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.934 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.895 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 619' ' ' TRP . . . . . 0.453 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.117 0 CA-C-O 120.684 0.278 . . . . 0.0 111.258 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 123.44 163.25 11.71 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.443 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -66.75 -39.11 15.93 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.542 2.162 . . . . 0.0 112.118 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -63.15 -39.25 94.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.888 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 623' ' ' VAL . . . . . 0.453 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 38.8 t -73.29 -35.32 46.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.781 179.701 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? -60.2 -42.43 95.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.689 179.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 4.8 tpp180 -69.32 -48.54 61.17 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.72 179.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 8.1 tt -61.45 -30.74 70.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.828 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -72.02 -50.63 26.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.201 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -57.2 -46.94 82.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.999 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 12.6 mt -64.47 -39.2 84.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.91 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 10.6 ttpt -60.77 -49.73 76.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.738 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 9.5 tttm -59.5 -38.17 80.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.75 179.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 632' ' ' HIS . . . . . 0.449 ' CE1' ' CD1' ' A' ' 709' ' ' LEU . 81.8 t60 -70.08 -44.25 69.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.83 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 633' ' ' LEU . . . . . 0.455 ' CD2' ' CD2' ' A' ' 702' ' ' TYR . 10.6 mt -55.89 -50.2 71.3 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.369 -179.552 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.92 -41.8 97.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.765 0.317 . . . . 0.0 110.75 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 6.7 t -73.5 -11.5 60.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.958 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 35.5 mm-40 -99.04 -10.59 22.41 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.551 -179.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 117.12 -0.83 19.31 Favored Glycine 0 C--N 1.332 0.34 0 C-N-CA 120.581 -0.819 . . . . 0.0 112.623 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 638' ' ' ILE . . . . . 0.416 HG21 ' CE2' ' A' ' 702' ' ' TYR . 13.8 mt -108.44 109.94 30.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 120.712 0.292 . . . . 0.0 111.327 -179.47 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 5.1 m -83.81 115.06 22.05 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.861 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 1.6 mtp -125.38 30.73 5.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.964 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -64.02 -30.76 71.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.956 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -74.51 -80.09 0.08 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.957 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 8.7 tp -179.08 132.09 0.27 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.845 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -74.49 137.86 23.55 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.481 2.121 . . . . 0.0 112.279 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 4.8 tp -129.19 151.6 49.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.187 0.518 . . . . 0.0 111.236 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 646' ' ' ILE . . . . . 0.408 ' CG2' ' HB3' ' A' ' 651' ' ' LEU . 1.3 tt -149.64 133.51 8.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.873 179.086 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 54.64 38.35 63.46 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.342 -0.933 . . . . 0.0 112.221 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.05 7.92 63.59 Favored Glycine 0 C--N 1.333 0.377 0 C-N-CA 120.924 -0.655 . . . . 0.0 113.595 179.353 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 2.1 m -133.73 163.89 28.45 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 117.315 0.557 . . . . 0.0 111.424 -179.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.28 145.52 35.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.669 179.679 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 651' ' ' LEU . . . . . 0.408 ' HB3' ' CG2' ' A' ' 646' ' ' ILE . 0.0 OUTLIER -134.79 145.0 47.97 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.085 0.469 . . . . 0.0 111.466 -179.615 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -96.85 109.25 21.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.725 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 8.2 mp -53.85 -35.29 61.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.949 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -65.02 -43.57 92.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.007 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 49.6 t -72.87 -33.6 66.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.655 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 656' ' ' PHE . . . . . 0.432 ' CE2' ' HG ' ' A' ' 682' ' ' LEU . 0.3 OUTLIER -71.47 -47.92 52.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.805 179.891 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -59.45 -49.16 78.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.893 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 22.2 tpp180 -59.66 -41.93 91.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.868 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.5 -49.18 78.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.103 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 660' ' ' ILE . . . . . 0.5 ' CG2' ' HA ' ' A' ' 666' ' ' MET . 27.9 mt -56.79 -45.66 83.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.791 0.329 . . . . 0.0 110.819 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -62.73 -42.31 99.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.884 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -72.11 -11.02 60.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.307 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -96.49 32.3 2.05 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.806 0.336 . . . . 0.0 111.047 -179.876 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 75.06 36.55 45.93 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.602 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 82.49 171.23 46.46 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.53 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 666' ' ' MET . . . . . 0.5 ' HA ' ' CG2' ' A' ' 660' ' ' ILE . 0.0 OUTLIER -72.49 -32.82 66.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.839 0.352 . . . . 0.0 111.035 179.962 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 27.5 tt0 -54.13 -48.88 70.32 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.193 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 668' ' ' GLN . . . . . 0.415 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -63.5 -50.63 68.88 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.827 0.346 . . . . 0.0 111.321 -179.632 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 57.2 t -49.04 -52.66 9.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.917 0.389 . . . . 0.0 111.159 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 670' ' ' THR . . . . . . . . . . . . . 7.6 t -76.3 -53.92 7.51 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -178.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -60.2 -51.41 69.68 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 -177.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 672' ' ' LEU . . . . . 0.415 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 6.9 mp -75.96 1.66 14.69 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -178.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 49.54 82.17 0.05 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.999 0.428 . . . . 0.0 110.297 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 11.1 ttpt -142.19 23.4 2.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.272 -179.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 675' ' ' TRP . . . . . 0.786 ' CE3' HD21 ' A' ' 678' ' ' LEU . 38.5 m95 -62.49 -28.54 69.9 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 121.361 0.6 . . . . 0.0 110.21 179.809 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -56.69 -44.41 81.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.49 -179.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.11 -51.51 12.07 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 120.814 0.34 . . . . 0.0 111.267 -179.602 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 678' ' ' LEU . . . . . 0.786 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.21 -40.44 70.79 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 179.523 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 679' ' ' ALA . . . . . 0.417 ' N ' ' CD2' ' A' ' 678' ' ' LEU . . . -71.64 -33.9 69.32 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.59 179.188 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -53.54 -48.73 68.81 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.484 179.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 2.4 mtm -64.12 -20.02 65.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.968 179.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 682' ' ' LEU . . . . . 0.432 ' HG ' ' CE2' ' A' ' 656' ' ' PHE . 3.7 mm? -81.85 -0.98 45.98 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.513 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 683' ' ' ARG . . . . . 0.427 ' HB2' ' O ' ' A' ' 682' ' ' LEU . 5.1 mmm180 66.84 71.88 0.37 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.895 0.379 . . . . 0.0 111.603 179.729 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 684' ' ' ILE . . . . . 0.467 HG21 ' HD2' ' A' ' 685' ' ' PRO . 2.1 mp -123.24 139.06 30.97 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.368 179.52 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 685' ' ' PRO . . . . . 0.467 ' HD2' HG21 ' A' ' 684' ' ' ILE . 33.0 Cg_endo -64.79 123.61 11.92 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.422 2.082 . . . . 0.0 112.454 -179.701 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 4.1 mmmt -69.92 -20.47 63.35 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.212 179.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 19.1 p -65.52 -23.86 66.98 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.555 -179.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -69.14 110.77 4.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.756 0.312 . . . . 0.0 111.323 -179.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -83.38 4.68 26.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.527 179.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -119.33 -17.79 8.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.904 0.383 . . . . 0.0 110.674 179.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 691' ' ' ARG . . . . . 0.467 ' O ' ' HB3' ' A' ' 695' ' ' LEU . 8.3 ptt85 -49.81 -36.47 26.61 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.542 -179.715 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -68.77 -52.64 28.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.623 -179.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.99 -39.65 69.1 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.838 0.352 . . . . 0.0 111.288 -179.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -61.86 -40.0 93.83 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.094 0.473 . . . . 0.0 110.15 179.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 695' ' ' LEU . . . . . 0.76 HD23 ' HB3' ' A' ' 675' ' ' TRP . 2.7 tp -65.57 -45.34 83.67 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.53 179.57 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 696' ' ' GLN . . . . . 0.449 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 9.8 mt-30 -55.43 -50.85 68.74 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.05 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -74.14 -29.67 61.92 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.01 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 698' ' ' ALA . . . . . 0.416 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.89 -39.29 83.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.602 -179.765 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 699' ' ' TYR . . . . . 0.517 ' CD2' ' CZ2' ' A' ' 675' ' ' TRP . 0.7 OUTLIER -86.0 -31.25 22.14 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.032 0.444 . . . . 0.0 110.485 179.84 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 700' ' ' CYS . . . . . 0.421 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 43.8 t -66.92 -30.52 70.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.852 179.89 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.14 -1.16 37.39 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.567 -179.719 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 702' ' ' TYR . . . . . 0.455 ' CD2' ' CD2' ' A' ' 633' ' ' LEU . 5.8 m-85 -119.06 -79.08 0.59 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.821 0.343 . . . . 0.0 111.326 -179.8 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 3.8 tp -56.44 -43.06 79.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.571 -179.395 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 704' ' ' LEU . . . . . 0.453 HD23 ' CE1' ' A' ' 699' ' ' TYR . 1.1 mm? -53.01 -37.17 61.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.893 0.378 . . . . 0.0 111.164 -179.771 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 3.9 m -65.63 -54.94 20.68 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.796 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 706' ' ' TYR . . . . . 0.492 ' CZ ' ' CE1' ' A' ' 714' ' ' HIS . 21.0 t80 -60.35 -29.19 68.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.738 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 4.8 p30 -96.91 -7.21 33.88 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -179.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 708' ' ' SER . . . . . 0.402 ' CB ' ' O ' ' A' ' 704' ' ' LEU . 41.8 m -102.89 -22.55 13.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.708 0.29 . . . . 0.0 111.363 -179.845 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 709' ' ' LEU . . . . . 0.449 ' CD1' ' CE1' ' A' ' 632' ' ' HIS . 0.2 OUTLIER -71.43 170.97 12.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.772 0.32 . . . . 0.0 111.005 -179.941 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.63 166.75 41.38 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.168 -179.687 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 711' ' ' PRO . . . . . 0.403 ' O ' ' HB2' ' A' ' 714' ' ' HIS . 38.0 Cg_endo -66.53 -32.03 40.25 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.57 2.18 . . . . 0.0 112.045 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -48.86 -48.69 41.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.578 179.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 713' ' ' GLU . . . . . 0.42 ' HB2' ' CD1' ' A' ' 709' ' ' LEU . 6.2 mm-40 -59.71 -26.2 65.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.111 179.633 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 714' ' ' HIS . . . . . 0.492 ' CE1' ' CZ ' ' A' ' 706' ' ' TYR . 1.6 m-70 -75.87 -54.05 7.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.387 179.665 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.77 -42.43 99.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.282 -179.657 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -66.37 -54.25 26.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.821 0.343 . . . . 0.0 111.16 -179.598 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 73.4 mt -63.64 -39.91 95.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.723 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -67.52 -54.32 21.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.302 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -50.72 -34.94 28.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.358 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 720' ' ' GLU . . . . . 0.409 ' O ' ' HG2' ' A' ' 723' ' ' MET . 2.9 mm-40 -70.51 -55.42 8.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.996 0.427 . . . . 0.0 110.723 179.842 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 38.6 t -62.48 -54.87 28.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.112 -179.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 3.6 mp -53.57 -40.04 65.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.872 -179.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 723' ' ' MET . . . . . 0.409 ' HG2' ' O ' ' A' ' 720' ' ' GLU . 9.5 ptp -74.59 -41.21 60.88 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 120.407 -0.517 . . . . 0.0 109.949 179.475 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -55.61 -42.74 75.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.835 -179.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 725' ' ' LYS . . . . . 0.421 ' HB3' ' CH2' ' A' ' 619' ' ' TRP . 0.0 OUTLIER -79.12 -36.66 40.27 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.661 -179.29 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -69.39 -53.27 20.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.837 0.351 . . . . 0.0 111.044 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 727' ' ' ILE . . . . . . . . . . . . . 3.7 mp -88.51 11.65 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.621 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 1.9 tt -53.98 -47.4 71.42 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.798 0.332 . . . . 0.0 111.121 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -73.21 -53.45 10.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.949 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 24.3 mtmt . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.896 179.968 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.236 0 N-CA-C 112.494 -0.242 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.0 -28.39 24.16 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.641 2.228 . . . . 0.0 112.287 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 11.3 mt -80.75 179.02 8.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.924 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 94.78 62.0 1.03 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.502 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -98.85 31.84 2.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.783 0.325 . . . . 0.0 110.928 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 23.3 mt -67.27 170.72 6.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.872 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 139.18 -52.85 0.71 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.517 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.89 -143.85 0.39 Allowed 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 110.445 -0.206 . . . . 0.0 110.445 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 6.5 mtt-85 -71.63 137.36 47.86 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.95 0.405 . . . . 0.0 111.169 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 619' ' ' TRP . . . . . 0.472 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.0 OUTLIER -82.66 -14.66 54.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.366 179.902 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 122.11 163.76 12.0 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.507 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -67.61 -40.76 9.59 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.597 2.198 . . . . 0.0 112.26 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 -62.27 -36.42 82.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.854 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 623' ' ' VAL . . . . . 0.472 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 43.0 t -75.77 -39.63 38.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.817 179.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 3.8 tm0? -64.76 -40.53 95.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.669 179.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.24 -49.97 65.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.736 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 7.1 tt -63.48 -32.13 73.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.914 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -71.49 -50.16 34.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.317 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.21 -46.46 82.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.157 -179.727 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 30.3 mt -64.24 -40.85 90.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.056 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 7.4 ttpt -62.82 -47.24 84.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.999 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 1.3 tttm -59.1 -40.47 85.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.258 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 632' ' ' HIS . . . . . 0.474 ' CE1' HD11 ' A' ' 709' ' ' LEU . 82.6 t60 -72.78 -42.1 64.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.085 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . 0.417 HD21 ' CE2' ' A' ' 702' ' ' TYR . 20.2 mt -55.96 -49.85 72.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.355 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 634' ' ' ARG . . . . . 0.406 ' HA ' ' O ' ' A' ' 638' ' ' ILE . 1.0 OUTLIER -68.34 -39.48 81.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.847 179.988 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 1.3 m -73.68 -11.58 60.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.353 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -100.32 -4.62 28.83 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 111.733 0.271 . . . . 0.0 111.733 -179.658 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 113.23 -0.44 25.27 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.493 -0.86 . . . . 0.0 112.593 179.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 638' ' ' ILE . . . . . 0.406 ' O ' ' HA ' ' A' ' 634' ' ' ARG . 13.7 mt -108.63 104.68 17.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-O 120.666 0.27 . . . . 0.0 111.202 -179.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 1.6 m -77.42 116.8 18.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.876 0.369 . . . . 0.0 110.94 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 2.1 ttp -130.49 30.7 4.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.838 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -66.81 -39.31 87.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.01 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -63.57 -79.9 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.935 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -178.37 132.34 0.3 Allowed Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.803 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.23 142.76 27.57 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.488 2.125 . . . . 0.0 112.266 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 4.8 tp -133.84 151.93 51.7 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.211 0.529 . . . . 0.0 111.211 179.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 646' ' ' ILE . . . . . 0.417 ' CG2' ' HB3' ' A' ' 651' ' ' LEU . 1.1 tt -149.8 133.89 8.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.905 179.107 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.41 38.55 57.8 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.363 -0.922 . . . . 0.0 112.097 -179.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.2 7.88 64.17 Favored Glycine 0 CA--C 1.52 0.385 0 C-N-CA 120.94 -0.648 . . . . 0.0 113.584 179.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -132.67 162.55 31.1 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 117.311 0.556 . . . . 0.0 111.4 -179.307 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.78 145.21 36.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.793 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 651' ' ' LEU . . . . . 0.417 ' HB3' ' CG2' ' A' ' 646' ' ' ILE . 0.0 OUTLIER -135.22 145.37 47.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.373 -179.695 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -99.89 113.33 25.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.944 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -52.37 -39.44 60.79 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.127 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -63.69 -43.88 95.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.03 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 10.6 t -70.07 -38.31 75.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.746 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 656' ' ' PHE . . . . . 0.42 ' CE1' ' HG ' ' A' ' 682' ' ' LEU . 0.1 OUTLIER -68.7 -46.3 69.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.794 179.943 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 43.9 t80 -57.46 -48.79 78.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.893 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -60.66 -40.73 93.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.955 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.95 -51.67 68.69 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.163 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 660' ' ' ILE . . . . . 0.445 ' CG2' ' HA ' ' A' ' 666' ' ' MET . 33.3 mt -56.75 -46.14 83.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 120.821 0.343 . . . . 0.0 111.127 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 23.6 t30 -61.43 -39.82 92.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.078 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -68.26 -13.85 62.56 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.51 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.46 36.61 1.24 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.797 0.332 . . . . 0.0 111.099 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 67.92 25.88 74.12 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.644 -0.788 . . . . 0.0 112.424 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 96.4 170.07 34.57 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.541 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 666' ' ' MET . . . . . 0.475 ' HE3' ' CE1' ' A' ' 699' ' ' TYR . 10.0 tpt -65.6 -37.74 87.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.727 0.298 . . . . 0.0 111.217 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 667' ' ' GLN . . . . . 0.432 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 4.9 pt20 -50.62 -43.69 56.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.449 -179.665 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 668' ' ' GLN . . . . . 0.413 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -66.96 -52.59 40.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.815 0.341 . . . . 0.0 110.973 -179.9 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 55.4 t -49.19 -54.65 5.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.461 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 670' ' ' THR . . . . . . . . . . . . . 14.0 t -76.15 -52.51 9.94 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -178.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 671' ' ' ASP . . . . . 0.432 ' CB ' ' O ' ' A' ' 667' ' ' GLN . 19.0 t70 -59.45 -51.15 71.12 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -177.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 672' ' ' LEU . . . . . 0.413 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 4.5 mm? -76.42 0.87 18.08 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 3.1 mtpm? 49.71 81.77 0.06 Allowed 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.017 0.437 . . . . 0.0 110.363 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 3.9 mttm -144.48 20.18 1.7 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.193 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 675' ' ' TRP . . . . . 0.718 ' HB3' HD22 ' A' ' 695' ' ' LEU . 26.0 m95 -55.75 -29.85 60.25 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.324 0.583 . . . . 0.0 110.236 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 -55.88 -41.7 74.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.843 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.69 -51.76 10.07 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.173 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.699 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -58.09 -40.51 81.32 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 179.691 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 679' ' ' ALA . . . . . . . . . . . . . . . -70.27 -36.13 74.22 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.554 179.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -53.36 -48.42 68.57 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.403 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 31.6 mtm -64.08 -23.07 67.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.844 179.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 682' ' ' LEU . . . . . 0.42 ' HG ' ' CE1' ' A' ' 656' ' ' PHE . 3.4 mm? -78.21 -3.12 41.07 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.472 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 3.4 mtp85 70.4 71.74 0.21 Allowed 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.915 0.388 . . . . 0.0 111.592 179.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 2.2 mp -123.66 141.37 36.39 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.223 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -69.07 120.94 7.77 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.543 2.162 . . . . 0.0 112.752 -179.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.01 -21.59 63.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.103 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.46 -22.33 66.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.601 -179.414 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 688' ' ' ALA . . . . . 0.516 ' O ' ' HG2' ' A' ' 691' ' ' ARG . . . -72.24 116.24 12.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.929 0.395 . . . . 0.0 111.218 -179.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -83.44 4.9 25.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.396 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -121.88 -15.18 7.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.087 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 691' ' ' ARG . . . . . 0.516 ' HG2' ' O ' ' A' ' 688' ' ' ALA . 0.5 OUTLIER -55.84 -32.8 63.92 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.088 -179.639 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -70.58 -54.12 13.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.462 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.23 -37.66 72.0 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.417 -179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 2.8 mmmt -64.28 -38.63 91.73 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.089 0.471 . . . . 0.0 109.896 179.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . 0.718 HD22 ' HB3' ' A' ' 675' ' ' TRP . 4.3 tp -64.9 -47.12 78.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.812 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -55.21 -49.01 73.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.206 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -76.02 -29.65 58.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.206 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . 0.406 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.26 -36.83 82.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.879 -179.585 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 699' ' ' TYR . . . . . 0.475 ' CE1' ' HE3' ' A' ' 666' ' ' MET . 1.5 p90 -85.63 -36.31 20.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.973 0.416 . . . . 0.0 110.495 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 700' ' ' CYS . . . . . . . . . . . . . 5.6 t -62.95 -30.59 71.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.538 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -96.77 -5.32 38.8 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.453 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 702' ' ' TYR . . . . . 0.417 ' CE2' HD21 ' A' ' 633' ' ' LEU . 6.1 m-85 -119.11 -78.21 0.58 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.851 0.358 . . . . 0.0 111.254 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -55.34 -42.62 74.07 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.47 -179.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.419 HD22 ' CE1' ' A' ' 699' ' ' TYR . 1.1 mm? -61.64 -56.03 24.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.144 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.65 -55.27 31.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.961 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 706' ' ' TYR . . . . . 0.412 ' CD2' HD13 ' A' ' 709' ' ' LEU . 53.1 t80 -59.59 -51.11 71.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.017 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -58.8 -20.57 51.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.282 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 1.4 m -84.29 -16.3 43.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.974 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 709' ' ' LEU . . . . . 0.496 ' HB3' ' HB2' ' A' ' 713' ' ' GLU . 62.3 mt -50.63 141.37 12.77 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.501 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 710' ' ' SER . . . . . 0.449 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.6 OUTLIER -75.92 168.25 29.5 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.597 179.742 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . 0.449 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 10.7 Cg_endo -54.13 -25.88 39.42 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.53 2.154 . . . . 0.0 112.376 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -69.98 -53.97 15.37 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.019 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 713' ' ' GLU . . . . . 0.496 ' HB2' ' HB3' ' A' ' 709' ' ' LEU . 62.1 mm-40 -59.73 -26.22 65.46 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.907 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 8.1 m-70 -75.89 -54.16 7.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.355 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.28 -41.77 99.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.344 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 2.8 mmm-85 -65.49 -54.2 31.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.858 0.361 . . . . 0.0 111.29 -179.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 55.0 mt -65.44 -40.63 93.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.015 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -67.99 -54.32 19.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.639 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.98 -34.55 56.52 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.465 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 720' ' ' GLU . . . . . 0.403 ' O ' ' HG2' ' A' ' 723' ' ' MET . 0.4 OUTLIER -67.51 -55.9 11.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.021 0.438 . . . . 0.0 110.494 179.832 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 33.3 t -64.06 -52.92 50.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.156 -179.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 5.1 mp -49.03 -44.8 41.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.918 -179.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 723' ' ' MET . . . . . 0.403 ' HG2' ' O ' ' A' ' 720' ' ' GLU . 18.8 ptp -72.19 -40.04 68.19 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.239 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -52.64 -34.84 53.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.436 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 725' ' ' LYS . . . . . 0.451 ' CD ' ' CE2' ' A' ' 619' ' ' TRP . 4.4 pttm -86.09 -40.29 15.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.455 -179.645 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -66.14 -52.59 46.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.383 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 727' ' ' ILE . . . . . 0.42 ' CG2' ' O ' ' A' ' 727' ' ' ILE . 4.6 mp -87.09 11.55 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.679 -179.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 4.9 tt -57.86 -32.57 67.78 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.881 0.372 . . . . 0.0 110.925 179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -65.63 -68.8 0.34 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.927 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.874 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.21 0 N-CA-C 112.581 -0.208 . . . . 0.0 112.581 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -53.13 -42.46 64.61 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.529 2.153 . . . . 0.0 112.287 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -88.27 162.64 16.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.887 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . -135.02 68.08 0.54 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.438 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 67.8 m 61.75 69.17 0.65 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.876 0.369 . . . . 0.0 110.803 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 28.9 mt -91.53 169.04 11.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.002 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 123.14 -74.49 0.38 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.456 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 3.2 mtp180 59.33 134.59 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 121.241 0.543 . . . . 0.0 111.441 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.43 140.11 30.25 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.82 179.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 619' ' ' TRP . . . . . 0.442 ' CE2' ' CD ' ' A' ' 725' ' ' LYS . 0.1 OUTLIER -72.41 -8.83 57.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.369 179.959 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 119.78 159.04 10.79 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.47 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -66.99 -40.9 10.9 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.578 2.186 . . . . 0.0 112.013 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 19.6 m-80 -64.61 -34.91 79.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.72 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 623' ' ' VAL . . . . . 0.411 HG13 ' CG ' ' A' ' 619' ' ' TRP . 38.6 t -72.98 -39.98 58.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.89 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 3.1 tm0? -60.63 -41.18 94.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.709 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 6.6 mpt_? -67.0 -50.83 60.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.824 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 8.3 tt -62.01 -29.97 70.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.041 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -70.98 -45.07 64.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.434 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -65.13 -38.85 91.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.262 -179.668 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 38.8 mt -66.8 -46.32 85.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.497 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 630' ' ' LYS . . . . . 0.453 ' HG3' ' N ' ' A' ' 631' ' ' LYS . 19.2 pttt -66.09 -32.6 74.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.798 0.332 . . . . 0.0 110.996 -179.819 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 631' ' ' LYS . . . . . 0.453 ' N ' ' HG3' ' A' ' 630' ' ' LYS . 0.0 OUTLIER -66.39 -44.76 82.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.991 0.424 . . . . 0.0 110.735 179.838 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 632' ' ' HIS . . . . . 0.46 ' CD2' HD12 ' A' ' 709' ' ' LEU . 86.2 t60 -71.3 -38.8 71.76 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.673 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . 0.422 HD13 ' CD2' ' A' ' 702' ' ' TYR . 47.6 mt -58.33 -49.8 75.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.016 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 634' ' ' ARG . . . . . 0.442 ' HG3' ' N ' ' A' ' 635' ' ' SER . 3.6 ptp180 -64.74 -40.32 95.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.866 0.365 . . . . 0.0 110.474 179.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 635' ' ' SER . . . . . 0.442 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 0.5 OUTLIER -73.86 -11.63 60.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.946 179.262 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 33.4 mm-40 -98.6 -7.12 28.66 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.564 -179.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 114.05 -1.05 24.17 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.584 -0.817 . . . . 0.0 112.497 179.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 638' ' ' ILE . . . . . . . . . . . . . 12.7 mt -108.11 104.77 17.61 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-O 120.635 0.255 . . . . 0.0 111.341 -179.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.6 121.19 21.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.825 0.345 . . . . 0.0 111.02 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 1.9 ttp -133.56 28.74 3.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.87 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -69.22 -30.71 68.94 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.913 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -71.61 -78.21 0.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.817 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 2.5 pp -179.93 128.37 0.24 Allowed Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.827 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -73.75 132.72 17.57 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.397 2.065 . . . . 0.0 112.289 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 4.9 tp -123.67 151.73 42.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.192 0.52 . . . . 0.0 111.276 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 646' ' ' ILE . . . . . 0.42 ' CG2' ' HB3' ' A' ' 651' ' ' LEU . 0.7 OUTLIER -149.68 133.41 8.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.979 179.108 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 54.93 37.7 63.18 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.365 -0.922 . . . . 0.0 112.228 -179.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.89 7.66 66.64 Favored Glycine 0 C--N 1.332 0.335 0 C-N-CA 120.942 -0.647 . . . . 0.0 113.563 179.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.9 m -134.36 164.38 27.56 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 117.35 0.575 . . . . 0.0 111.417 -179.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.69 145.67 36.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.757 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 651' ' ' LEU . . . . . 0.42 ' HB3' ' CG2' ' A' ' 646' ' ' ILE . 0.0 OUTLIER -134.93 145.15 47.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.384 -179.71 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -98.3 111.93 24.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.888 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -52.16 -35.74 49.53 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.056 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -68.61 -44.93 73.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.115 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 10.7 t -67.99 -36.73 80.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.656 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 656' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -68.46 -44.47 74.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.826 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 56.6 t80 -58.69 -48.73 80.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.904 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 1.4 ttm180 -59.31 -43.03 92.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.99 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.22 -49.71 73.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.145 -179.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 660' ' ' ILE . . . . . 0.437 ' CG2' ' HA ' ' A' ' 666' ' ' MET . 16.9 mt -57.43 -44.71 85.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.821 0.343 . . . . 0.0 110.786 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -65.31 -47.52 76.28 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.271 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -55.5 -20.44 12.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.747 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.82 19.6 3.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.517 0.199 . . . . 0.0 111.508 -179.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 90.84 -18.19 51.73 Favored Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.562 -0.827 . . . . 0.0 112.725 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 147.37 175.34 20.12 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.369 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 666' ' ' MET . . . . . 0.497 ' HE1' ' CZ ' ' A' ' 699' ' ' TYR . 0.0 OUTLIER -72.04 -36.69 69.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.898 0.38 . . . . 0.0 111.067 -179.928 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 667' ' ' GLN . . . . . 0.405 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 3.9 pt20 -56.08 -42.78 77.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.255 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 668' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.07 -45.14 86.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.956 0.408 . . . . 0.0 110.82 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 57.7 t -57.64 -55.71 19.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.564 -179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 670' ' ' THR . . . . . . . . . . . . . 9.7 t -76.04 -54.18 7.24 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.219 0.822 . . . . 0.0 113.219 -178.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 671' ' ' ASP . . . . . 0.405 ' CB ' ' O ' ' A' ' 667' ' ' GLN . 7.1 t0 -56.21 -51.11 69.26 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -178.328 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 28.0 mt -75.0 -1.81 24.36 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -179.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 11.3 mttp 50.46 84.15 0.04 OUTLIER 'General case' 0 CA--C 1.521 -0.151 0 CA-C-O 121.098 0.475 . . . . 0.0 110.371 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 5.6 tptm -148.73 21.63 1.01 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.138 -179.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 675' ' ' TRP . . . . . 0.733 ' HB3' HD23 ' A' ' 695' ' ' LEU . 27.5 m95 -56.26 -29.8 61.58 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 121.469 0.652 . . . . 0.0 109.996 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -56.45 -41.5 76.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.633 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.39 -51.75 10.29 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -179.309 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.728 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -57.32 -39.81 76.6 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.747 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 679' ' ' ALA . . . . . 0.4 ' N ' ' CD2' ' A' ' 678' ' ' LEU . . . -71.56 -34.64 70.16 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.45 179.053 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -53.59 -47.78 69.82 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.267 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.89 -21.55 66.46 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.779 179.306 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 682' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -78.28 -2.85 39.94 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.46 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 71.66 71.79 0.17 Allowed 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.928 0.394 . . . . 0.0 111.251 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 2.1 mp -124.67 135.57 26.81 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.368 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -64.92 124.58 13.31 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.563 2.176 . . . . 0.0 112.506 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.79 -17.27 63.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.294 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.42 -24.0 67.09 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.702 0.287 . . . . 0.0 111.237 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -79.31 112.28 16.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.921 0.391 . . . . 0.0 110.873 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -72.39 -68.35 0.48 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.329 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.44 -12.9 0.78 Allowed 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -179.153 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 691' ' ' ARG . . . . . . . . . . . . . 43.5 ptt85 -47.95 -42.79 28.41 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 120.919 0.39 . . . . 0.0 111.076 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -60.99 -46.95 88.67 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.041 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.28 -39.0 68.67 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.886 0.375 . . . . 0.0 111.242 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 2.4 mttm -64.45 -38.73 92.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.246 179.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . 0.733 HD23 ' HB3' ' A' ' 675' ' ' TRP . 0.9 OUTLIER -67.09 -44.23 80.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.488 179.756 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . 0.43 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 4.2 mm-40 -55.43 -48.03 75.06 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.011 0.434 . . . . 0.0 110.816 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -76.82 -29.45 55.96 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.01 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . 0.433 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.35 -37.87 83.93 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.675 -179.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 699' ' ' TYR . . . . . 0.497 ' CZ ' ' HE1' ' A' ' 666' ' ' MET . 1.3 p90 -84.34 -35.08 23.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.892 0.377 . . . . 0.0 110.691 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 700' ' ' CYS . . . . . . . . . . . . . 28.8 t -64.86 -30.54 71.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.956 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -98.56 -2.41 38.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.581 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 702' ' ' TYR . . . . . 0.433 ' CD1' ' O ' ' A' ' 698' ' ' ALA . 4.8 m-85 -118.44 -78.83 0.59 Allowed 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.85 0.357 . . . . 0.0 111.343 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 90.9 mt -59.82 -40.86 89.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.636 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.41 HD21 ' CD1' ' A' ' 699' ' ' TYR . 0.8 OUTLIER -58.23 -55.34 36.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.92 0.39 . . . . 0.0 111.252 -179.682 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.57 -54.94 34.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.046 -179.656 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 706' ' ' TYR . . . . . 0.431 ' CD1' HD11 ' A' ' 709' ' ' LEU . 77.0 t80 -58.4 -50.32 74.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.206 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.78 -27.12 64.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.28 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 18.0 p -79.45 -16.88 55.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.178 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 709' ' ' LEU . . . . . 0.46 HD12 ' CD2' ' A' ' 632' ' ' HIS . 63.1 mt -53.37 147.34 10.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.935 0.398 . . . . 0.0 111.484 -179.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 710' ' ' SER . . . . . 0.446 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.4 OUTLIER -76.32 169.03 22.88 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.476 179.492 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . 0.446 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 15.9 Cg_endo -57.48 -21.61 46.58 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.473 2.115 . . . . 0.0 112.531 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -70.53 -53.6 15.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.056 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 713' ' ' GLU . . . . . 0.452 ' HB2' ' HB3' ' A' ' 709' ' ' LEU . 5.3 mm-40 -59.17 -26.05 64.44 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.521 -0.308 . . . . 0.0 111.125 -179.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 11.6 m-70 -75.91 -54.25 7.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.038 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 715' ' ' ARG . . . . . 0.409 ' O ' ' CG ' ' A' ' 719' ' ' LYS . 0.0 OUTLIER -64.1 -32.88 74.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.654 -179.243 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 7.9 mtt-85 -77.15 -54.22 6.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.926 0.393 . . . . 0.0 111.209 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 63.8 mt -62.74 -40.29 96.78 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.802 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -65.24 -54.59 27.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.637 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 719' ' ' LYS . . . . . 0.409 ' CG ' ' O ' ' A' ' 715' ' ' ARG . 0.7 OUTLIER -51.07 -36.76 41.76 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.425 -179.622 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 720' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -67.36 -55.78 12.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.977 0.418 . . . . 0.0 110.653 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 39.5 t -61.92 -54.16 38.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.076 -179.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 4.6 mp -48.95 -45.67 42.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.858 -179.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 723' ' ' MET . . . . . . . . . . . . . 15.7 ptp -73.11 -42.0 63.41 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 120.464 -0.495 . . . . 0.0 109.859 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -54.23 -31.24 52.83 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.31 -179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 725' ' ' LYS . . . . . 0.442 ' CD ' ' CE2' ' A' ' 619' ' ' TRP . 3.5 pttm -86.16 -36.61 19.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.335 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 726' ' ' GLU . . . . . 0.42 ' N ' ' HG3' ' A' ' 725' ' ' LYS . 4.9 mt-10 -71.65 -52.86 15.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.911 0.386 . . . . 0.0 111.124 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 727' ' ' ILE . . . . . . . . . . . . . 3.7 mp -87.63 11.66 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.68 -179.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.73 -48.96 79.39 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.745 0.307 . . . . 0.0 111.101 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -57.34 -32.46 66.75 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.1 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.197 -0.906 . . . . 0.0 110.884 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 112.587 -0.205 . . . . 0.0 112.587 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_exo -51.91 -53.41 7.03 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.641 2.227 . . . . 0.0 112.285 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.1 mp -71.39 165.58 23.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.919 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . -113.94 63.39 0.3 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.509 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -152.74 109.0 3.38 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.81 0.338 . . . . 0.0 110.924 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 9.9 mt -119.17 -178.91 3.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.891 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -99.38 -78.68 1.4 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.516 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.25 -143.07 0.38 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 110.578 -0.156 . . . . 0.0 110.578 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 15.6 mmt85 70.41 147.24 0.07 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.802 0.334 . . . . 0.0 110.698 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 619' ' ' TRP . . . . . 0.454 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.1 OUTLIER -76.55 -6.99 54.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.565 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 122.42 157.9 10.09 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.42 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -68.84 -36.21 14.07 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.549 2.166 . . . . 0.0 112.025 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 54.9 m-80 -71.87 -30.91 65.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.696 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 623' ' ' VAL . . . . . 0.454 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 38.5 t -75.76 -37.49 35.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.617 179.583 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 2.6 tm0? -66.39 -43.49 85.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.578 179.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 6.3 mmt85 -63.43 -50.45 69.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.567 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 2.8 tt -61.06 -35.17 76.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.74 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -72.22 -46.06 57.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.204 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -58.39 -46.81 85.65 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.094 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 31.2 mt -66.75 -37.71 80.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.09 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.11 -48.46 81.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.883 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -63.47 -40.5 97.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.009 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 632' ' ' HIS . . . . . 0.451 ' CE1' ' CD1' ' A' ' 709' ' ' LEU . 67.8 t60 -66.51 -43.78 84.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.829 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . 0.426 HD11 ' CD2' ' A' ' 702' ' ' TYR . 49.7 mt -56.38 -49.92 73.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.175 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 634' ' ' ARG . . . . . 0.428 ' HG3' ' N ' ' A' ' 635' ' ' SER . 0.9 OUTLIER -60.82 -40.64 93.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.813 0.339 . . . . 0.0 110.717 179.914 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 635' ' ' SER . . . . . 0.428 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 49.1 m -73.74 -19.52 60.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.024 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -90.08 -10.46 44.65 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.586 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 119.07 -7.04 12.97 Favored Glycine 0 C--N 1.331 0.298 0 C-N-CA 120.613 -0.804 . . . . 0.0 112.524 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 638' ' ' ILE . . . . . 0.428 HG23 ' CZ ' ' A' ' 702' ' ' TYR . 3.6 mp -101.18 104.62 16.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.669 0.271 . . . . 0.0 111.143 -179.662 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 1.6 m -78.34 108.14 11.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.895 0.379 . . . . 0.0 110.869 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 1.9 mtp -122.33 28.61 7.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.98 -179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -61.0 -31.38 70.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.853 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 51.8 mm-40 -72.39 -78.23 0.09 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.865 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 1.1 pp -177.37 138.54 0.42 Allowed Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.888 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.65 136.92 19.71 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.562 2.175 . . . . 0.0 112.379 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 4.6 tp -133.75 150.95 51.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.245 0.545 . . . . 0.0 111.267 179.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 646' ' ' ILE . . . . . . . . . . . . . 1.4 tt -149.82 133.93 8.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.702 178.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.15 39.95 58.77 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.319 -0.943 . . . . 0.0 112.429 -179.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.03 7.14 61.86 Favored Glycine 0 C--N 1.333 0.381 0 C-N-CA 120.904 -0.665 . . . . 0.0 113.799 179.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -133.57 164.26 27.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 117.396 0.598 . . . . 0.0 111.374 -179.403 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -79.33 144.35 34.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.748 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 651' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -134.59 144.99 48.25 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.306 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -94.81 105.09 17.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.932 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 5.6 mp -53.88 -38.69 65.02 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.975 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -63.57 -43.16 97.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.982 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 1.7 t -69.82 -31.66 69.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.465 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 656' ' ' PHE . . . . . 0.441 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.1 OUTLIER -72.42 -44.66 62.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.827 179.789 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -59.75 -48.47 81.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.843 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.75 -43.3 99.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.112 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.57 -49.38 78.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.404 -179.648 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 660' ' ' ILE . . . . . 0.465 ' CG2' ' HA ' ' A' ' 666' ' ' MET . 85.6 mt -56.75 -45.64 82.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.793 0.33 . . . . 0.0 110.993 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.76 -44.23 86.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.109 -179.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -64.16 -32.47 74.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.159 -179.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 1.2 mtm -72.73 -9.6 58.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.479 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 119.27 38.38 0.74 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.339 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 75.93 173.16 34.54 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.718 -0.754 . . . . 0.0 112.428 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 666' ' ' MET . . . . . 0.484 ' HE2' ' CZ ' ' A' ' 699' ' ' TYR . 10.5 tpt -66.45 -41.67 88.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.682 0.277 . . . . 0.0 111.366 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 667' ' ' GLN . . . . . 0.439 ' O ' ' HB2' ' A' ' 671' ' ' ASP . 5.6 pt20 -50.37 -46.66 56.1 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -179.157 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 668' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -50.78 69.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.887 0.375 . . . . 0.0 111.059 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 48.9 t -55.74 -55.5 17.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.911 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 670' ' ' THR . . . . . . . . . . . . . 15.2 t -75.95 -52.45 10.25 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -178.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 671' ' ' ASP . . . . . 0.439 ' HB2' ' O ' ' A' ' 667' ' ' GLN . 0.8 OUTLIER -60.79 -50.97 71.33 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -178.203 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 26.3 mt -76.39 1.61 15.84 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 2.3 mttm 49.86 82.96 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.021 0.439 . . . . 0.0 110.266 -179.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 1.4 ttmp? -142.73 23.73 1.91 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.304 -179.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 675' ' ' TRP . . . . . 0.764 ' CE3' HD22 ' A' ' 678' ' ' LEU . 37.8 m95 -62.4 -27.64 69.23 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.337 0.589 . . . . 0.0 110.211 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -57.67 -45.48 85.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.482 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.01 -51.61 13.17 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.742 0.306 . . . . 0.0 111.445 -179.382 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.764 HD22 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -56.01 -40.55 73.55 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 179.624 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 679' ' ' ALA . . . . . 0.413 ' N ' ' CD2' ' A' ' 678' ' ' LEU . . . -71.71 -31.87 67.2 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.496 179.18 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.18 -49.69 71.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.194 179.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 1.9 ttm -62.38 -21.44 65.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.603 179.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 682' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -80.55 -1.51 42.28 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.371 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 10.3 mmm180 68.84 71.77 0.28 Allowed 'General case' 0 N--CA 1.462 0.126 0 CA-C-O 120.936 0.398 . . . . 0.0 110.861 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 1.7 mp -118.78 136.48 24.23 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.926 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.52 123.68 11.43 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.486 2.124 . . . . 0.0 112.272 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -16.85 63.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.387 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.29 -23.79 67.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.01 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 688' ' ' ALA . . . . . 0.435 ' CB ' ' HB2' ' A' ' 691' ' ' ARG . . . -84.51 106.08 15.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.846 0.355 . . . . 0.0 110.95 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -73.17 -68.56 0.48 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.325 -179.576 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -51.97 -19.76 2.0 Allowed 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -179.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 691' ' ' ARG . . . . . 0.435 ' HB2' ' CB ' ' A' ' 688' ' ' ALA . 0.0 OUTLIER -46.2 -39.43 9.74 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.789 0.328 . . . . 0.0 111.223 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -58.61 -45.35 89.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.844 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.11 -37.51 69.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.99 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.8 -40.85 97.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.224 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . 0.743 HD21 ' HB3' ' A' ' 675' ' ' TRP . 0.3 OUTLIER -65.44 -44.31 87.71 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.18 179.499 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . 0.431 ' O ' ' CD2' ' A' ' 699' ' ' TYR . 42.9 tt0 -55.76 -45.88 77.98 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.884 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.25 -29.89 54.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.041 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . 0.449 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -66.42 -37.58 85.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.483 -179.757 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 699' ' ' TYR . . . . . 0.484 ' CZ ' ' HE2' ' A' ' 666' ' ' MET . 1.7 p90 -86.04 -33.92 20.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.074 0.464 . . . . 0.0 110.233 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 700' ' ' CYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 1.4 m -63.1 -30.53 71.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.867 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -100.97 -1.81 33.44 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.478 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 702' ' ' TYR . . . . . 0.449 ' CD1' ' O ' ' A' ' 698' ' ' ALA . 4.5 m-85 -117.57 -75.94 0.58 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.94 0.4 . . . . 0.0 111.4 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 20.2 mt -64.27 -41.73 96.78 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.812 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.473 HD22 ' CE1' ' A' ' 699' ' ' TYR . 0.4 OUTLIER -47.92 -56.91 6.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.848 0.356 . . . . 0.0 111.431 -179.496 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 1.4 m -54.64 -46.44 73.93 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.27 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 706' ' ' TYR . . . . . 0.412 ' CZ ' ' NE2' ' A' ' 714' ' ' HIS . 67.7 t80 -63.43 -29.47 70.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.346 -179.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -96.92 -2.47 43.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.709 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 57.8 m -113.2 -21.57 10.93 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.727 0.298 . . . . 0.0 111.36 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 709' ' ' LEU . . . . . 0.451 ' CD1' ' CE1' ' A' ' 632' ' ' HIS . 0.2 OUTLIER -69.56 171.54 8.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.885 179.981 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -72.66 164.29 61.36 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.008 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.26 -29.88 54.81 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.544 2.163 . . . . 0.0 111.959 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -51.07 -50.81 57.97 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.75 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 713' ' ' GLU . . . . . 0.435 ' HB2' ' CD1' ' A' ' 709' ' ' LEU . 1.6 mm-40 -58.26 -28.21 64.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.935 179.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 714' ' ' HIS . . . . . 0.412 ' NE2' ' CZ ' ' A' ' 706' ' ' TYR . 1.7 m170 -76.02 -54.01 7.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.583 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.68 -44.64 96.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.37 -179.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 2.0 mtp-105 -65.66 -54.16 31.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.273 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 76.8 mt -62.98 -41.13 99.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.787 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -66.82 -54.12 25.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.3 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.74 -34.62 27.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.347 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 720' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -68.54 -55.63 11.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.009 0.433 . . . . 0.0 110.428 179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 44.7 t -61.55 -53.66 45.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.808 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 3.6 mp -48.69 -46.43 40.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.884 -179.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 723' ' ' MET . . . . . 0.404 ' HG3' ' N ' ' A' ' 724' ' ' GLU . 16.5 ptp -71.49 -41.01 69.85 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.566 -0.454 . . . . 0.0 109.873 179.399 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 724' ' ' GLU . . . . . 0.404 ' N ' ' HG3' ' A' ' 723' ' ' MET . 1.9 mm-40 -53.48 -32.8 51.79 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.403 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 725' ' ' LYS . . . . . 0.437 ' CD ' ' CE2' ' A' ' 619' ' ' TRP . 8.7 pttt -86.18 -41.92 14.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.314 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -66.23 -54.0 30.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.882 0.373 . . . . 0.0 111.147 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 727' ' ' ILE . . . . . . . . . . . . . 4.3 mp -86.94 11.51 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.746 -179.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 1.7 tt -57.65 -42.15 82.88 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.817 0.342 . . . . 0.0 111.168 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -59.62 -51.06 71.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.123 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 9.4 mtpt . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.861 -179.955 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.19 0 N-CA-C 112.453 -0.259 . . . . 0.0 112.453 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -68.1 -39.71 10.14 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.569 2.179 . . . . 0.0 112.302 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -71.45 178.11 3.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.88 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 105.36 -83.01 0.35 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.506 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 5.4 p 59.22 108.93 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.849 0.357 . . . . 0.0 110.969 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 6.3 mt -138.98 -169.92 2.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.888 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -122.91 -94.41 1.18 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.492 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 1.6 mmm180 -147.52 121.74 9.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.047 0.451 . . . . 0.0 110.716 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.78 125.38 50.49 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.893 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 619' ' ' TRP . . . . . 0.455 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.0 OUTLIER -61.0 -18.38 57.35 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.29 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 120.57 169.14 13.84 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.489 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -68.15 -38.71 11.8 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.59 2.193 . . . . 0.0 112.174 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -62.46 -42.64 99.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.93 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 623' ' ' VAL . . . . . 0.455 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 40.5 t -72.15 -35.01 51.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.845 179.704 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 2.1 tm0? -57.7 -47.32 82.69 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.766 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.69 -43.5 75.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.796 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 6.2 tt -59.7 -36.93 77.51 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.971 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -72.77 -46.29 54.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.293 -179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.17 -46.82 82.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.054 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 23.5 mt -66.63 -40.04 85.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.122 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 6.1 ttpt -62.9 -49.41 74.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.905 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 2.7 tttm -58.13 -42.57 86.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.036 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 632' ' ' HIS . . . . . 0.453 ' CE1' HD12 ' A' ' 709' ' ' LEU . 79.9 t60 -68.27 -41.92 80.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.974 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . 0.423 HD21 ' CD2' ' A' ' 702' ' ' TYR . 39.1 mt -56.04 -47.41 77.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.21 -179.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 1.7 ptt180 -65.43 -41.75 93.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.77 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.78 -13.57 60.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.304 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 636' ' ' GLN . . . . . 0.45 ' CG ' ' CE1' ' A' ' 632' ' ' HIS . 62.4 mm-40 -96.21 -9.46 30.41 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.619 -179.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 118.89 -9.86 12.3 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.595 -0.812 . . . . 0.0 112.371 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 638' ' ' ILE . . . . . 0.419 HG22 ' CE2' ' A' ' 702' ' ' TYR . 3.5 mp -98.79 104.75 16.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.708 0.29 . . . . 0.0 111.074 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -80.61 116.08 20.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.963 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 640' ' ' MET . . . . . 0.41 ' HB3' ' HE3' ' A' ' 640' ' ' MET . 1.5 ttp -124.26 16.66 9.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.182 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.79 -31.21 62.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.839 0.352 . . . . 0.0 111.036 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -70.91 -73.67 0.17 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.786 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 1.9 pp -179.73 130.77 0.25 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.749 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.11 124.79 9.81 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.432 2.088 . . . . 0.0 112.287 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 4.8 tp -127.36 152.76 47.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.28 0.562 . . . . 0.0 111.323 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 646' ' ' ILE . . . . . 0.408 ' CG2' ' HB3' ' A' ' 651' ' ' LEU . 4.4 tt -149.65 133.42 8.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.486 178.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 50.71 43.01 46.46 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.25 -0.976 . . . . 0.0 112.212 -179.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 68.86 6.77 53.44 Favored Glycine 0 CA--C 1.52 0.39 0 C-N-CA 121.068 -0.587 . . . . 0.0 113.908 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 62.4 m -130.9 161.97 30.69 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 117.609 0.705 . . . . 0.0 111.636 -179.072 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -80.41 142.57 34.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.759 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 651' ' ' LEU . . . . . 0.425 ' O ' HD12 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -135.16 145.3 47.64 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.298 -179.742 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -96.36 111.64 23.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.787 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -51.97 -38.94 58.41 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.029 -179.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -65.04 -44.35 89.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.055 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -68.55 -33.9 74.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.862 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 656' ' ' PHE . . . . . 0.438 ' CE2' HD11 ' A' ' 682' ' ' LEU . 0.7 OUTLIER -72.88 -45.16 59.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.853 -179.96 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -61.39 -46.48 89.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.725 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.96 -45.32 95.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.816 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.62 -48.76 76.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.933 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 660' ' ' ILE . . . . . 0.434 HG12 ' CD1' ' A' ' 678' ' ' LEU . 76.9 mt -58.2 -45.48 88.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.927 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 14.4 m-20 -64.74 -46.54 81.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.231 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.38 -40.71 71.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.179 -179.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.95 -27.22 68.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.028 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 131.69 46.98 0.12 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.347 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 75.99 176.45 40.81 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.505 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 666' ' ' MET . . . . . 0.437 ' HE2' ' CE1' ' A' ' 699' ' ' TYR . 0.0 OUTLIER -73.11 -30.58 63.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.768 0.318 . . . . 0.0 111.109 -179.975 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 667' ' ' GLN . . . . . 0.423 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 4.3 pt20 -57.25 -45.77 83.67 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.641 -179.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 668' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -52.76 42.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.838 0.351 . . . . 0.0 111.336 -179.615 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 66.8 t -49.51 -54.97 5.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.572 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 670' ' ' THR . . . . . 0.407 HG21 ' O ' ' A' ' 666' ' ' MET . 12.3 t -76.18 -49.59 16.8 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 -178.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 671' ' ' ASP . . . . . 0.423 ' CB ' ' O ' ' A' ' 667' ' ' GLN . 7.9 t70 -62.95 -51.16 67.96 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -177.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 10.7 mp -79.04 3.6 16.85 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -179.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 14.7 ttmm 48.56 84.81 0.03 OUTLIER 'General case' 0 C--O 1.231 0.13 0 CA-C-O 120.971 0.415 . . . . 0.0 110.507 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt -145.06 22.9 1.54 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.24 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 675' ' ' TRP . . . . . 0.779 ' CE3' HD23 ' A' ' 678' ' ' LEU . 39.4 m95 -61.24 -28.63 69.3 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 121.397 0.617 . . . . 0.0 110.112 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 -56.9 -43.9 81.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.484 -179.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.14 -51.52 12.0 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.755 0.312 . . . . 0.0 111.44 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.779 HD23 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.59 -40.39 71.98 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 179.645 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 679' ' ' ALA . . . . . 0.42 ' N ' ' CD2' ' A' ' 678' ' ' LEU . . . -71.83 -33.61 68.62 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.513 179.074 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.33 -49.5 66.96 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.211 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 19.9 mtm -62.92 -22.62 66.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.67 179.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 682' ' ' LEU . . . . . 0.461 ' O ' ' HB2' ' A' ' 683' ' ' ARG . 3.5 mm? -79.53 -1.23 36.74 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.333 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . 0.461 ' HB2' ' O ' ' A' ' 682' ' ' LEU . 0.2 OUTLIER 69.38 71.81 0.25 Allowed 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 120.951 0.405 . . . . 0.0 111.065 -179.83 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . 0.41 HG13 ' NH2' ' A' ' 691' ' ' ARG . 1.7 mp -119.81 135.7 24.39 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.72 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . 0.405 ' HD2' HG22 ' A' ' 684' ' ' ILE . 36.7 Cg_endo -65.99 123.16 10.9 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.411 2.074 . . . . 0.0 112.375 -179.899 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -16.4 63.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.167 179.853 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.46 -23.74 66.99 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.12 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 688' ' ' ALA . . . . . 0.422 ' CB ' ' HB2' ' A' ' 691' ' ' ARG . . . -85.25 105.36 15.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.834 0.349 . . . . 0.0 111.011 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 -70.32 -68.35 0.43 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.141 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -53.33 -17.8 2.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.909 -179.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 691' ' ' ARG . . . . . 0.422 ' HB2' ' CB ' ' A' ' 688' ' ' ALA . 0.0 OUTLIER -46.82 -35.25 6.08 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.905 0.383 . . . . 0.0 111.143 179.904 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -66.28 -40.74 90.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.869 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.11 -37.65 69.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.889 179.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 20.9 mmtt -64.3 -40.66 96.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.173 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . 0.744 HD22 ' HB3' ' A' ' 675' ' ' TRP . 0.8 OUTLIER -64.83 -44.55 89.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.377 179.545 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . 0.43 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 3.1 mt-30 -55.42 -46.3 76.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.815 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.08 -29.63 55.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.132 179.888 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -67.49 -38.53 84.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.581 -179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 699' ' ' TYR . . . . . 0.478 ' CD2' ' CZ2' ' A' ' 675' ' ' TRP . 1.1 p90 -85.69 -31.82 22.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.948 0.404 . . . . 0.0 110.516 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 700' ' ' CYS . . . . . 0.409 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 1.6 m -65.77 -30.61 71.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.476 179.509 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -97.11 -8.47 30.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.37 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 702' ' ' TYR . . . . . 0.423 ' CD2' HD21 ' A' ' 633' ' ' LEU . 4.0 m-85 -113.47 -78.99 0.58 Allowed 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.829 0.347 . . . . 0.0 111.367 -179.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 61.6 mt -56.17 -46.55 79.31 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.618 -179.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.421 HD21 ' CE1' ' A' ' 699' ' ' TYR . 1.0 OUTLIER -53.97 -48.62 70.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.901 0.382 . . . . 0.0 110.887 -179.928 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 705' ' ' SER . . . . . 0.408 ' O ' ' CD1' ' A' ' 709' ' ' LEU . 4.4 m -54.63 -54.97 34.54 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.347 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 706' ' ' TYR . . . . . 0.497 ' CE2' ' CE1' ' A' ' 714' ' ' HIS . 18.4 t80 -46.81 -43.59 18.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.787 -179.678 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -94.49 1.61 55.73 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 29.7 t -80.56 -20.29 43.74 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 709' ' ' LEU . . . . . 0.453 HD12 ' CE1' ' A' ' 632' ' ' HIS . 0.0 OUTLIER -94.62 -174.27 3.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.824 0.345 . . . . 0.0 111.46 -179.768 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 710' ' ' SER . . . . . 0.414 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.4 OUTLIER -85.3 167.06 27.54 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.965 -179.817 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . 0.414 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 18.8 Cg_endo -58.92 -17.86 39.44 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.608 2.205 . . . . 0.0 112.765 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -60.12 -52.75 64.02 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.8 0.333 . . . . 0.0 110.889 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 713' ' ' GLU . . . . . . . . . . . . . 65.9 mm-40 -64.47 -25.88 68.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.955 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 714' ' ' HIS . . . . . 0.497 ' CE1' ' CE2' ' A' ' 706' ' ' TYR . 0.1 OUTLIER -74.91 -54.63 6.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.171 179.599 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 15.5 mmm180 -65.25 -36.21 83.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.274 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 18.6 mtt180 -65.52 -54.23 31.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.822 0.344 . . . . 0.0 110.993 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 30.5 mt -62.77 -34.84 78.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.694 179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -69.39 -53.9 17.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.394 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -52.34 -34.09 45.72 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.432 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 720' ' ' GLU . . . . . 0.42 ' O ' ' HG2' ' A' ' 723' ' ' MET . 1.0 OUTLIER -69.35 -55.81 9.33 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.019 0.437 . . . . 0.0 110.389 179.775 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 21.5 t -61.8 -53.13 52.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.053 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 6.9 mp -51.81 -42.49 62.54 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.009 -179.271 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 723' ' ' MET . . . . . 0.42 ' HG2' ' O ' ' A' ' 720' ' ' GLU . 14.2 ptp -71.91 -39.71 69.32 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.487 -0.485 . . . . 0.0 109.994 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 724' ' ' GLU . . . . . 0.404 ' N ' ' HG3' ' A' ' 723' ' ' MET . 1.4 mt-10 -56.29 -32.0 64.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.291 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 725' ' ' LYS . . . . . 0.431 ' HD3' ' CE2' ' A' ' 619' ' ' TRP . 7.5 pttt -86.15 -43.84 12.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.298 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -63.96 -48.43 76.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.922 0.392 . . . . 0.0 110.982 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 727' ' ' ILE . . . . . 0.412 ' CG2' ' O ' ' A' ' 727' ' ' ILE . 4.3 mp -89.46 11.57 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.526 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 1.5 tt -57.69 -34.52 69.51 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.794 0.33 . . . . 0.0 110.959 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -76.88 -53.08 8.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.953 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 3.1 mttt . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.935 179.979 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.161 0 N-CA-C 112.515 -0.234 . . . . 0.0 112.515 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -52.55 -35.46 66.99 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.555 2.17 . . . . 0.0 112.272 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.8 mt -71.96 -175.46 1.45 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.849 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 111.1 -24.66 15.72 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.608 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 8.7 t -94.65 43.88 1.1 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.851 0.357 . . . . 0.0 110.961 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 25.9 mt -83.04 169.09 16.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.875 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -168.24 54.06 0.22 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.525 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 2.3 mpp_? -123.24 -146.0 0.35 Allowed 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 110.433 -0.21 . . . . 0.0 110.433 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.42 117.01 10.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.94 0.4 . . . . 0.0 111.038 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 619' ' ' TRP . . . . . 0.427 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.5 OUTLIER -60.75 173.15 0.79 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.813 179.853 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . -55.99 170.58 2.22 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.468 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.76 -49.42 2.28 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.509 2.139 . . . . 0.0 112.09 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.61 -20.64 49.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.288 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 623' ' ' VAL . . . . . 0.427 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 28.9 t -75.7 -45.93 37.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.911 0.386 . . . . 0.0 110.472 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.08 -43.81 94.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.163 179.341 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.06 -50.86 71.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.537 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 7.4 tt -62.54 -33.27 74.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.949 0.404 . . . . 0.0 110.542 179.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -69.46 -46.83 65.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.267 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -62.28 -44.64 96.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.128 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 629' ' ' ILE . . . . . 0.459 ' HA ' ' CD2' ' A' ' 632' ' ' HIS . 14.6 mt -60.54 -45.08 97.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.99 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 13.8 ttpt -64.13 -34.32 77.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.231 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.36 -48.03 74.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.641 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 632' ' ' HIS . . . . . 0.459 ' CD2' ' HA ' ' A' ' 629' ' ' ILE . 1.1 p80 -68.53 -37.83 80.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.823 0.344 . . . . 0.0 110.558 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . 0.425 ' HG ' ' CE1' ' A' ' 632' ' ' HIS . 32.1 mt -55.73 -49.95 71.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.121 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 4.1 ptt180 -65.25 -40.99 94.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.78 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 1.4 m -73.75 -13.33 60.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.408 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.39 -6.56 33.79 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.661 -179.654 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 111.96 4.21 26.11 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.6 -0.809 . . . . 0.0 112.57 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 638' ' ' ILE . . . . . . . . . . . . . 17.7 mt -110.77 106.09 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-O 120.72 0.295 . . . . 0.0 111.238 -179.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.2 118.4 24.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.892 0.377 . . . . 0.0 110.816 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 640' ' ' MET . . . . . 0.441 ' HB3' ' HE3' ' A' ' 640' ' ' MET . 1.5 ttp -121.45 23.01 10.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.174 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -58.08 -30.61 66.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.011 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -71.23 -79.49 0.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.853 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -178.36 133.82 0.31 Allowed Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.839 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -77.79 118.24 4.44 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.582 2.188 . . . . 0.0 112.388 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 4.9 tp -118.58 152.55 35.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.226 0.536 . . . . 0.0 111.181 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 646' ' ' ILE . . . . . 0.416 ' CG2' ' HB3' ' A' ' 651' ' ' LEU . 15.8 tt -149.67 133.88 8.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.828 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 52.28 40.24 52.59 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.363 -0.922 . . . . 0.0 112.239 -179.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.33 8.0 61.49 Favored Glycine 0 C--N 1.333 0.382 0 C-N-CA 120.913 -0.66 . . . . 0.0 113.686 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.2 m -133.51 163.3 29.68 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 117.366 0.583 . . . . 0.0 111.368 -179.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -79.84 144.67 33.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.657 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 651' ' ' LEU . . . . . 0.416 ' HB3' ' CG2' ' A' ' 646' ' ' ILE . 0.0 OUTLIER -134.62 145.07 48.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.352 -179.783 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -97.08 109.76 22.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.841 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 5.7 mp -52.14 -37.84 55.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.004 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -66.05 -44.05 85.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.174 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 5.7 t -69.9 -36.45 75.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.67 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 656' ' ' PHE . . . . . 0.42 ' CZ ' ' HG ' ' A' ' 682' ' ' LEU . 0.2 OUTLIER -70.93 -45.85 63.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.831 179.998 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -57.73 -50.57 72.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.993 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.87 -41.17 95.41 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.989 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . 0.409 ' CD2' ' CD2' ' A' ' 682' ' ' LEU . 0.1 OUTLIER -59.0 -49.85 76.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.111 -179.794 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 660' ' ' ILE . . . . . 0.456 ' CG2' ' HA ' ' A' ' 666' ' ' MET . 62.8 mt -56.87 -46.14 83.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.767 0.318 . . . . 0.0 110.882 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -61.81 -38.08 86.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.016 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 51.6 tt0 -66.69 -14.73 62.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.422 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.16 33.59 1.72 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.824 0.345 . . . . 0.0 111.101 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 72.46 25.16 74.94 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.641 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 97.48 169.61 32.93 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.583 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 666' ' ' MET . . . . . 0.495 ' HE2' ' CE1' ' A' ' 699' ' ' TYR . 9.6 tpt -64.82 -37.47 87.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.703 0.287 . . . . 0.0 111.116 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 667' ' ' GLN . . . . . 0.448 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 8.3 pt20 -50.79 -44.13 58.76 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.308 -179.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 668' ' ' GLN . . . . . 0.418 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -65.85 -52.74 47.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.903 0.382 . . . . 0.0 110.922 179.959 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 48.4 t -49.57 -55.83 4.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.687 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 670' ' ' THR . . . . . 0.401 ' CG2' ' N ' ' A' ' 671' ' ' ASP . 14.0 t -76.27 -53.67 7.9 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.658 0.984 . . . . 0.0 113.658 -178.491 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 671' ' ' ASP . . . . . 0.448 ' CB ' ' O ' ' A' ' 667' ' ' GLN . 6.3 t70 -58.56 -51.17 71.03 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -177.654 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 672' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 9.1 mp -77.22 1.84 17.27 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -178.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 49.07 83.43 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.13 0.49 . . . . 0.0 110.532 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.18 22.7 1.36 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.646 -0.707 . . . . 0.0 110.981 -179.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 675' ' ' TRP . . . . . 0.738 ' HB3' HD22 ' A' ' 695' ' ' LEU . 29.3 m95 -58.47 -28.63 65.51 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 121.391 0.615 . . . . 0.0 110.204 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 14.8 m-80 -56.11 -41.59 75.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.895 -179.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 6.3 mmtp -77.8 -51.82 9.89 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 120.703 0.287 . . . . 0.0 111.66 -179.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.697 HD23 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -58.06 -40.86 82.07 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.862 -0.421 . . . . 0.0 109.862 179.689 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 679' ' ' ALA . . . . . 0.402 ' N ' ' CD2' ' A' ' 678' ' ' LEU . . . -71.56 -33.76 69.38 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.423 179.028 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.74 -49.07 68.96 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.395 179.513 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 2.9 ttp -64.57 -22.37 66.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.906 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 682' ' ' LEU . . . . . 0.439 ' O ' ' HB2' ' A' ' 683' ' ' ARG . 3.1 mm? -78.3 -2.99 40.7 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.446 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . 0.439 ' HB2' ' O ' ' A' ' 682' ' ' LEU . 37.7 mmt180 70.02 71.8 0.23 Allowed 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.979 0.418 . . . . 0.0 111.497 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 2.0 mp -122.22 141.9 35.59 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.073 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -69.67 119.42 6.37 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.511 2.141 . . . . 0.0 112.655 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 8.3 mmmt -69.87 -21.89 63.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.095 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -65.35 -21.6 66.71 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.389 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 688' ' ' ALA . . . . . 0.48 ' O ' ' HG2' ' A' ' 691' ' ' ARG . . . -72.58 115.75 12.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.873 0.368 . . . . 0.0 111.007 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 67.0 mm-40 -83.39 5.9 21.93 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.49 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -123.81 -15.19 7.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.946 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 691' ' ' ARG . . . . . 0.48 ' HG2' ' O ' ' A' ' 688' ' ' ALA . 0.0 OUTLIER -53.42 -33.1 52.68 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-O 120.744 0.307 . . . . 0.0 110.951 -179.609 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . 0.414 HD21 ' CD ' ' A' ' 691' ' ' ARG . 3.2 mm? -70.57 -49.54 46.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.056 179.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.19 -39.65 68.46 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.501 -179.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 6.3 mtpt -64.01 -38.85 92.58 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.033 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . 0.738 HD22 ' HB3' ' A' ' 675' ' ' TRP . 4.0 tp -65.08 -47.32 77.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.827 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . 0.4 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 43.5 mt-30 -55.33 -46.8 76.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.105 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -76.95 -29.67 55.69 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.131 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . 0.415 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.97 -37.48 81.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.797 -179.506 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 699' ' ' TYR . . . . . 0.495 ' CE1' ' HE2' ' A' ' 666' ' ' MET . 1.2 p90 -86.6 -33.5 20.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.032 0.444 . . . . 0.0 110.442 179.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 700' ' ' CYS . . . . . 0.417 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 1.8 m -65.78 -30.46 71.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.887 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -98.53 -1.52 40.92 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.549 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 702' ' ' TYR . . . . . 0.416 ' CD2' HD23 ' A' ' 633' ' ' LEU . 7.6 m-85 -122.55 -75.94 0.59 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.791 0.329 . . . . 0.0 111.308 -179.87 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 19.7 mt -56.0 -44.55 78.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.439 -179.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.46 HD23 ' CE1' ' A' ' 699' ' ' TYR . 0.9 OUTLIER -54.84 -27.17 40.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.15 -179.91 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 705' ' ' SER . . . . . 0.42 ' HB3' ' CE1' ' A' ' 632' ' ' HIS . 0.2 OUTLIER -67.99 -55.52 12.37 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.557 179.901 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 706' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -53.15 -46.62 68.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.147 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -74.82 -19.42 60.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.526 -179.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 40.0 t -88.99 -35.21 16.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.767 0.318 . . . . 0.0 111.21 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 709' ' ' LEU . . . . . . . . . . . . . 71.8 mt -56.67 150.06 16.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.184 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 710' ' ' SER . . . . . 0.422 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.5 OUTLIER -75.7 166.82 42.1 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.8 179.953 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . 0.422 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 11.4 Cg_endo -54.8 -26.08 45.99 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.542 2.161 . . . . 0.0 112.334 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.84 -53.35 58.43 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.747 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 713' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -60.21 -26.21 66.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.033 179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 17.4 m170 -75.83 -54.38 7.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.944 0.402 . . . . 0.0 110.471 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 17.0 mtt180 -60.56 -47.62 85.4 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.461 -179.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.93 -54.17 34.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.568 -179.394 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 73.9 mt -62.38 -41.93 99.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.978 -179.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -65.95 -54.25 28.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.836 0.35 . . . . 0.0 110.2 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 1.5 mmpt? -50.42 -33.57 21.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.331 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 720' ' ' GLU . . . . . 0.402 ' O ' ' HG2' ' A' ' 723' ' ' MET . 12.7 mt-10 -69.25 -55.36 10.76 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.578 179.648 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 25.2 t -64.06 -54.99 24.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.922 -179.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . 0.421 ' O ' ' HG3' ' A' ' 725' ' ' LYS . 1.1 mp -49.16 -43.37 41.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.724 -179.524 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 723' ' ' MET . . . . . 0.402 ' HG2' ' O ' ' A' ' 720' ' ' GLU . 8.0 ptp -73.85 -40.48 63.25 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.562 -0.455 . . . . 0.0 109.942 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -51.08 -38.06 49.43 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.532 -179.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 725' ' ' LYS . . . . . 0.421 ' HG3' ' O ' ' A' ' 722' ' ' LEU . 0.0 OUTLIER -86.08 -34.78 20.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.732 0.301 . . . . 0.0 111.088 -179.787 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -65.35 -54.33 30.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.026 0.441 . . . . 0.0 110.789 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 727' ' ' ILE . . . . . . . . . . . . . 4.1 mp -88.48 11.49 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.539 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 2.7 tt -59.12 -48.0 83.2 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.833 0.349 . . . . 0.0 111.094 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -60.51 -50.05 75.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.097 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.873 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.191 0 N-CA-C 112.478 -0.249 . . . . 0.0 112.478 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -68.26 -47.33 1.67 Allowed 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.534 2.156 . . . . 0.0 112.402 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 2.5 mp -73.68 177.3 5.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.85 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 84.04 -71.14 3.03 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.476 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 30.1 t 60.59 91.24 0.06 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.817 0.342 . . . . 0.0 110.902 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 3.6 mt -118.0 163.69 16.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.882 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 59.46 70.83 0.89 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.496 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.53 -144.08 0.36 Allowed 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 110.587 -0.153 . . . . 0.0 110.587 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.8 124.38 19.59 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.005 0.431 . . . . 0.0 111.159 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 619' ' ' TRP . . . . . 0.435 ' CG ' ' HB ' ' A' ' 623' ' ' VAL . 0.5 OUTLIER -52.43 178.6 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.779 179.598 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . -66.3 169.48 32.35 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.452 -0.88 . . . . 0.0 111.907 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -64.15 -29.04 64.98 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.365 2.044 . . . . 0.0 111.862 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 46.4 m-80 -63.94 -38.61 91.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.932 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 623' ' ' VAL . . . . . 0.435 ' HB ' ' CG ' ' A' ' 619' ' ' TRP . 41.4 t -73.3 -36.65 49.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.116 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 3.0 tm0? -59.41 -48.09 82.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.839 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.49 -49.41 66.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.024 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 9.6 tt -62.32 -31.19 71.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.063 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -66.79 -52.16 47.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.3 -179.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 1.3 m -57.14 -53.19 60.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.124 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 18.8 mt -58.92 -39.84 78.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.054 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 4.1 tmmm? -59.81 -40.48 88.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.837 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 4.8 tttm -66.08 -40.76 91.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.001 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 632' ' ' HIS . . . . . 0.446 ' CG ' HD12 ' A' ' 709' ' ' LEU . 67.3 t60 -68.34 -44.95 74.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.031 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . 0.451 ' CD2' ' CD2' ' A' ' 702' ' ' TYR . 25.6 mt -56.53 -49.82 73.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.26 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 18.4 ptt180 -61.87 -41.72 98.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.841 0.353 . . . . 0.0 110.913 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.63 -19.49 60.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.25 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -89.1 -8.55 53.62 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.646 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 113.3 3.92 24.0 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.39 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 638' ' ' ILE . . . . . 0.421 HG21 ' CE2' ' A' ' 702' ' ' TYR . 17.2 mt -111.5 104.83 17.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-O 120.747 0.308 . . . . 0.0 111.267 -179.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -82.59 110.78 17.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.868 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 1.8 ttp -121.11 30.73 6.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.966 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.32 -29.81 71.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.873 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -71.57 -76.18 0.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.019 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -179.75 139.24 0.32 Allowed Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.846 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_endo -77.95 138.52 16.6 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.603 2.202 . . . . 0.0 112.455 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 4.8 tp -134.9 151.21 50.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.229 0.538 . . . . 0.0 111.121 179.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 646' ' ' ILE . . . . . 0.406 ' CG2' ' HB3' ' A' ' 651' ' ' LEU . 1.2 tt -148.96 132.55 7.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.386 -0.824 . . . . 0.0 109.533 178.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 52.26 43.18 56.97 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.3 -0.952 . . . . 0.0 112.21 -179.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 68.71 6.61 51.49 Favored Glycine 0 C--N 1.334 0.453 0 C-N-CA 121.032 -0.604 . . . . 0.0 113.91 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 87.0 m -131.51 163.07 28.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 117.507 0.654 . . . . 0.0 111.513 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -80.5 143.88 32.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.798 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 651' ' ' LEU . . . . . 0.406 ' HB3' ' CG2' ' A' ' 646' ' ' ILE . 0.0 OUTLIER -135.0 144.93 47.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.344 -179.841 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -94.02 107.99 19.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.971 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 7.2 mp -54.32 -42.89 70.67 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.997 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -61.44 -46.68 89.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.013 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 1.1 t -66.79 -35.6 80.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.743 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 656' ' ' PHE . . . . . 0.42 ' CD2' HD12 ' A' ' 682' ' ' LEU . 0.2 OUTLIER -70.68 -42.46 70.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.887 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -59.78 -52.04 67.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.039 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 16.9 ttt180 -59.97 -43.41 95.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.093 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.84 -43.32 80.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.024 -179.845 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 660' ' ' ILE . . . . . 0.431 HG12 ' CD1' ' A' ' 678' ' ' LEU . 89.4 mt -64.26 -43.61 97.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.736 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -64.17 -45.89 86.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.052 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -61.23 -21.0 63.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.178 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.81 8.77 21.4 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.503 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 98.87 25.64 9.59 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.638 -0.792 . . . . 0.0 112.644 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 92.0 174.8 42.48 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.561 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 666' ' ' MET . . . . . 0.418 ' HG2' ' CG2' ' A' ' 660' ' ' ILE . 0.0 OUTLIER -69.66 -25.69 64.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.661 0.267 . . . . 0.0 111.09 179.863 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 667' ' ' GLN . . . . . 0.404 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 15.9 pt20 -59.1 -48.51 81.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.797 -179.358 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 668' ' ' GLN . . . . . 0.418 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -64.82 -52.81 54.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.897 0.379 . . . . 0.0 111.225 -179.483 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 669' ' ' VAL . . . . . 0.42 HG11 ' CD1' ' A' ' 675' ' ' TRP . 57.5 t -49.54 -55.35 4.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.681 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 670' ' ' THR . . . . . 0.4 HG22 ' O ' ' A' ' 666' ' ' MET . 10.6 t -76.44 -48.53 19.38 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 -178.176 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 671' ' ' ASP . . . . . 0.404 ' CB ' ' O ' ' A' ' 667' ' ' GLN . 5.0 t70 -66.31 -51.08 60.93 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -177.649 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 672' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 11.1 mp -77.52 3.83 12.6 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -179.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 48.92 84.18 0.03 OUTLIER 'General case' 0 C--O 1.231 0.125 0 CA-C-O 120.936 0.398 . . . . 0.0 110.446 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 62.1 tttt -145.65 22.16 1.46 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.327 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 675' ' ' TRP . . . . . 0.769 ' CE3' HD22 ' A' ' 678' ' ' LEU . 34.9 m95 -61.13 -28.91 69.45 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 121.381 0.61 . . . . 0.0 110.125 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -56.02 -43.43 77.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.546 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.41 -51.61 11.5 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 120.687 0.28 . . . . 0.0 111.538 -179.279 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.769 HD22 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.01 -41.21 71.0 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 179.738 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 679' ' ' ALA . . . . . 0.413 ' N ' ' CD2' ' A' ' 678' ' ' LEU . . . -71.55 -34.66 70.19 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.743 179.346 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -53.23 -48.54 68.08 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.452 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 3.9 ttm -63.81 -21.56 66.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.702 179.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 682' ' ' LEU . . . . . 0.428 ' O ' ' HB2' ' A' ' 683' ' ' ARG . 2.2 mm? -80.48 -1.87 43.49 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.402 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . 0.428 ' HB2' ' O ' ' A' ' 682' ' ' LEU . 0.3 OUTLIER 71.23 71.74 0.18 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.887 0.375 . . . . 0.0 111.293 179.95 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . 0.418 HG22 ' CZ ' ' A' ' 691' ' ' ARG . 1.7 mp -120.57 137.16 25.93 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.626 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -67.51 123.91 11.38 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.47 2.113 . . . . 0.0 112.328 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -69.94 -13.7 62.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.412 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 1.5 p -65.34 -22.28 66.8 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.748 0.309 . . . . 0.0 111.253 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 688' ' ' ALA . . . . . 0.45 ' CB ' ' HB2' ' A' ' 691' ' ' ARG . . . -88.46 100.16 12.83 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.889 0.376 . . . . 0.0 110.937 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 13.1 mp0 -68.53 -67.56 0.46 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.289 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -52.81 -19.26 2.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.872 -179.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 691' ' ' ARG . . . . . 0.45 ' HB2' ' CB ' ' A' ' 688' ' ' ALA . 0.0 OUTLIER -45.39 -42.04 9.76 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.783 0.325 . . . . 0.0 111.347 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -56.58 -42.69 79.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.955 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.99 -37.18 69.9 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.79 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 1.3 ttpp -64.62 -40.23 95.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.241 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . 0.75 HD23 ' HB3' ' A' ' 675' ' ' TRP . 0.4 OUTLIER -65.13 -44.08 89.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.254 179.517 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . 0.447 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 2.0 mt-30 -55.48 -45.96 76.94 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.798 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -77.16 -29.66 54.59 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.073 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . 0.412 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.63 -39.03 84.66 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.599 -179.796 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 699' ' ' TYR . . . . . 0.461 ' CD2' ' CZ2' ' A' ' 675' ' ' TRP . 1.3 p90 -84.72 -32.78 23.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.88 0.371 . . . . 0.0 110.488 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 700' ' ' CYS . . . . . . . . . . . . . 32.6 t -66.03 -30.62 71.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.721 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -97.65 -2.07 42.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.329 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 702' ' ' TYR . . . . . 0.451 ' CD2' ' CD2' ' A' ' 633' ' ' LEU . 6.8 m-85 -121.61 -74.83 0.6 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.869 0.366 . . . . 0.0 111.245 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 1.7 tp -58.37 -48.4 80.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.589 -179.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.433 HD21 ' CE1' ' A' ' 699' ' ' TYR . 0.6 OUTLIER -50.17 -47.62 54.38 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.861 0.362 . . . . 0.0 111.481 -179.663 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.66 -55.19 32.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.128 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 706' ' ' TYR . . . . . 0.406 ' CE2' ' CE1' ' A' ' 714' ' ' HIS . 57.9 t80 -66.78 -29.7 69.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.276 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -76.29 -18.82 58.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.43 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 36.6 p -95.87 -14.65 23.0 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.703 0.287 . . . . 0.0 111.437 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 709' ' ' LEU . . . . . 0.446 HD12 ' CG ' ' A' ' 632' ' ' HIS . 70.2 mt -56.46 151.12 13.83 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.939 0.4 . . . . 0.0 111.358 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 710' ' ' SER . . . . . 0.407 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.6 OUTLIER -78.76 169.73 19.38 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.603 179.66 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . 0.407 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 55.7 Cg_endo -70.06 -12.83 33.07 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.519 2.146 . . . . 0.0 112.851 -179.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -75.47 -56.78 4.37 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.847 0.356 . . . . 0.0 111.109 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 713' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.93 -25.41 64.56 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.689 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 714' ' ' HIS . . . . . 0.406 ' CE1' ' CE2' ' A' ' 706' ' ' TYR . 0.4 OUTLIER -70.03 -54.79 11.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.298 -0.41 . . . . 0.0 109.921 179.361 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 2.2 tpt180 -60.65 -40.31 91.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.056 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 27.6 ttp180 -65.33 -53.78 38.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.091 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 47.1 mt -60.45 -41.48 94.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.795 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -66.99 -54.15 24.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.441 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.8 -31.6 27.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.482 -179.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 720' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -72.06 -55.39 7.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.006 0.431 . . . . 0.0 110.514 179.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 40.2 t -62.6 -54.6 31.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.757 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . 0.4 ' O ' ' CG ' ' A' ' 725' ' ' LYS . 7.0 mp -53.6 -40.81 66.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.852 -179.389 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 723' ' ' MET . . . . . 0.41 ' HG3' ' N ' ' A' ' 724' ' ' GLU . 8.2 ptp -71.34 -39.15 71.52 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.024 179.551 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 724' ' ' GLU . . . . . 0.41 ' N ' ' HG3' ' A' ' 723' ' ' MET . 6.6 mm-40 -57.92 -31.32 66.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.119 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 725' ' ' LYS . . . . . 0.426 ' HD3' ' NE1' ' A' ' 619' ' ' TRP . 11.4 pttt -86.12 -34.45 20.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.443 -179.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 726' ' ' GLU . . . . . 0.403 ' N ' ' HG3' ' A' ' 725' ' ' LYS . 3.5 mm-40 -73.5 -47.55 40.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.282 -179.529 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 727' ' ' ILE . . . . . 0.421 ' CG2' ' O ' ' A' ' 727' ' ' ILE . 4.0 mp -88.16 11.6 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.635 -179.789 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 3.2 tt -64.41 -35.75 81.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.817 0.341 . . . . 0.0 110.837 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -58.64 -43.6 89.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.985 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 1.7 mtmt . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.858 -179.992 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.155 0 N-CA-C 112.538 -0.225 . . . . 0.0 112.538 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.91 -32.45 17.93 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.569 2.179 . . . . 0.0 112.343 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.32 156.16 39.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.892 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 164.85 149.34 5.78 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.51 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -112.74 31.1 6.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.813 0.339 . . . . 0.0 110.912 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 25.0 mt -95.26 -179.08 4.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.86 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -143.21 78.08 0.27 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.479 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 17.5 mmt85 -118.29 -144.88 0.37 Allowed 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 110.479 -0.193 . . . . 0.0 110.479 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.76 135.93 33.4 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.861 0.362 . . . . 0.0 111.024 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 619' ' ' TRP . . . . . 0.444 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.1 OUTLIER -66.67 -13.95 61.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.387 179.967 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 124.29 165.08 12.12 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.363 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -70.6 -41.93 2.88 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.596 2.197 . . . . 0.0 112.461 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -66.75 -30.93 71.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.01 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 623' ' ' VAL . . . . . 0.444 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 55.5 t -74.96 -40.8 45.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.917 0.389 . . . . 0.0 110.442 179.391 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 35.7 tp60 -65.09 -34.59 78.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.951 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 81.6 mtm-85 -64.7 -50.72 65.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.248 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -62.02 -32.14 72.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.691 179.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -74.04 -53.92 8.96 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.744 -179.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 25.0 p -57.07 -42.38 80.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.24 -179.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 55.4 mt -68.68 -40.48 81.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.882 0.373 . . . . 0.0 110.732 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 2.5 ttpt -62.0 -46.57 88.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.718 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 5.3 tttm -65.18 -40.52 94.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.088 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 632' ' ' HIS . . . . . 0.443 ' CE1' ' CG ' ' A' ' 636' ' ' GLN . 79.3 t60 -68.85 -44.85 72.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.084 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . 0.428 HD23 ' CD2' ' A' ' 702' ' ' TYR . 35.6 mt -56.21 -49.91 72.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.308 -179.623 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -62.73 -42.29 99.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.997 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.74 -16.1 61.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.299 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 636' ' ' GLN . . . . . 0.443 ' CG ' ' CE1' ' A' ' 632' ' ' HIS . 67.8 mm-40 -92.67 -9.12 42.0 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.563 -179.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 114.41 0.33 23.52 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.374 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 638' ' ' ILE . . . . . 0.427 HG23 ' CE2' ' A' ' 702' ' ' TYR . 11.4 mt -108.16 105.41 18.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 CA-C-O 120.767 0.318 . . . . 0.0 111.254 -179.531 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.29 109.82 17.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.851 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 1.7 mtp -118.16 28.71 8.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.961 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.88 -38.15 90.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.903 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -60.96 -76.4 0.05 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.997 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -178.74 123.28 0.24 Allowed Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.761 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -63.26 139.95 74.73 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.488 2.125 . . . . 0.0 112.33 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 5.0 tp -142.01 153.2 44.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.269 0.557 . . . . 0.0 111.223 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 646' ' ' ILE . . . . . 0.413 ' CG2' ' HB3' ' A' ' 651' ' ' LEU . 3.2 tt -149.84 133.76 8.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.466 178.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 49.72 43.43 37.99 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.192 -1.004 . . . . 0.0 111.98 -179.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 68.48 6.02 46.7 Favored Glycine 0 CA--C 1.521 0.427 0 C-N-CA 121.149 -0.548 . . . . 0.0 113.972 179.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.3 m -129.58 160.89 31.87 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 117.586 0.693 . . . . 0.0 111.697 -178.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -78.9 140.62 38.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.824 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 651' ' ' LEU . . . . . 0.413 ' HB3' ' CG2' ' A' ' 646' ' ' ILE . 0.0 OUTLIER -134.63 144.92 48.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.14 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -96.86 111.65 23.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.866 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -54.62 -37.77 66.01 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.89 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -63.91 -46.0 86.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.893 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 33.8 t -66.71 -35.43 80.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.646 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 656' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -70.53 -44.58 67.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.783 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 36.2 t80 -58.01 -43.26 86.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.73 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -66.1 -43.59 86.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.692 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.68 -52.39 65.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.215 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 660' ' ' ILE . . . . . 0.436 HG12 ' CD1' ' A' ' 678' ' ' LEU . 57.1 mt -57.87 -45.19 87.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.049 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -64.61 -44.27 91.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.396 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -55.13 -22.9 18.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.412 -179.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 12.6 mtm -95.49 35.91 1.3 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.853 0.358 . . . . 0.0 110.845 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 88.23 -50.8 3.91 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.354 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 171.76 -174.73 45.23 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 121.025 -0.607 . . . . 0.0 111.914 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 666' ' ' MET . . . . . 0.504 ' HE1' ' CE2' ' A' ' 699' ' ' TYR . 11.1 tpt -73.08 -30.35 63.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.872 0.368 . . . . 0.0 110.899 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -57.65 -49.1 77.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.412 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 668' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.66 -52.7 62.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.858 0.361 . . . . 0.0 111.294 -179.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 56.4 t -49.31 -55.41 4.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.792 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 670' ' ' THR . . . . . . . . . . . . . 14.1 t -76.09 -49.64 16.87 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -178.284 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 63.8 m-20 -61.97 -51.07 69.57 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 -177.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 9.1 mp -78.93 5.2 12.14 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 48.87 83.63 0.04 OUTLIER 'General case' 0 C--O 1.231 0.122 0 CA-C-O 120.994 0.426 . . . . 0.0 110.535 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 14.8 mttm -142.46 22.98 2.0 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.188 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 675' ' ' TRP . . . . . 0.782 ' CE3' HD22 ' A' ' 678' ' ' LEU . 37.7 m95 -61.44 -27.62 68.69 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.358 0.599 . . . . 0.0 110.221 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 -57.3 -45.57 84.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.613 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.45 -51.63 12.58 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 120.703 0.287 . . . . 0.0 111.587 -179.355 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.782 HD22 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -54.9 -40.64 70.02 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 179.759 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 679' ' ' ALA . . . . . 0.431 ' N ' ' CD2' ' A' ' 678' ' ' LEU . . . -71.78 -33.9 68.99 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.602 179.312 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.22 -50.37 64.88 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.417 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 2.8 mtp -62.11 -19.88 63.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.78 179.301 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 682' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -84.71 -1.5 56.27 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.384 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 23.3 mmm-85 70.86 71.69 0.19 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.946 0.403 . . . . 0.0 111.029 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . 0.425 HG21 ' HD2' ' A' ' 685' ' ' PRO . 1.6 mp -121.1 137.47 26.71 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.654 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . 0.425 ' HD2' HG21 ' A' ' 684' ' ' ILE . 38.9 Cg_endo -67.09 121.84 9.06 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.391 2.06 . . . . 0.0 112.381 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.91 -18.95 63.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.269 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -65.37 -22.15 66.77 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.241 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 688' ' ' ALA . . . . . 0.4 ' CB ' ' HB2' ' A' ' 691' ' ' ARG . . . -84.53 105.23 15.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.977 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 20.0 mp0 -70.12 -68.61 0.41 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.164 -179.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -51.73 -20.69 2.25 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.798 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 691' ' ' ARG . . . . . 0.412 ' CZ ' HG13 ' A' ' 684' ' ' ILE . 0.0 OUTLIER -47.98 -36.4 12.59 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.865 0.364 . . . . 0.0 111.121 179.873 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -65.38 -45.72 82.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.898 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.02 -37.9 69.69 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.855 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.92 -39.64 94.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.08 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . 0.694 HD22 ' HB3' ' A' ' 675' ' ' TRP . 0.2 OUTLIER -65.95 -42.15 90.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.135 179.408 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . 0.432 ' O ' ' CD1' ' A' ' 699' ' ' TYR . 23.5 mt-30 -57.48 -44.09 84.6 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.786 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -77.31 -30.0 53.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.157 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . 0.424 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -66.6 -37.75 85.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.442 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 699' ' ' TYR . . . . . 0.504 ' CE2' ' HE1' ' A' ' 666' ' ' MET . 1.8 p90 -86.54 -34.91 19.81 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.108 0.48 . . . . 0.0 109.961 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 700' ' ' CYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 52.4 t -61.01 -30.59 70.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.617 179.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -99.75 -3.4 32.91 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.351 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 702' ' ' TYR . . . . . 0.428 ' CD2' HD23 ' A' ' 633' ' ' LEU . 4.8 m-85 -115.47 -77.16 0.57 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.882 0.372 . . . . 0.0 111.366 -179.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 1.9 tp -63.6 -40.63 97.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.662 -179.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.453 ' CD2' ' CE2' ' A' ' 699' ' ' TYR . 0.5 OUTLIER -54.06 -50.63 66.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.902 0.382 . . . . 0.0 111.207 -179.68 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -54.3 -54.6 38.08 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.897 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 706' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -57.78 -28.87 64.38 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.415 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -96.99 -1.82 44.79 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -106.82 -20.82 13.22 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.584 0.23 . . . . 0.0 111.602 -179.436 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 709' ' ' LEU . . . . . 0.443 ' CD1' ' HB2' ' A' ' 713' ' ' GLU . 0.2 OUTLIER -77.54 176.15 9.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.799 0.333 . . . . 0.0 110.97 -179.846 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.16 164.98 57.38 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.158 -179.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -66.68 -28.93 43.85 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.653 2.235 . . . . 0.0 112.102 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -48.86 -48.75 41.71 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.702 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 713' ' ' GLU . . . . . 0.443 ' HB2' ' CD1' ' A' ' 709' ' ' LEU . 3.5 mm-40 -61.34 -26.38 67.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.059 179.713 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -76.04 -54.28 7.09 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.989 0.423 . . . . 0.0 110.322 179.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.31 -43.27 96.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.336 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.61 -53.96 34.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.824 0.345 . . . . 0.0 111.168 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 76.2 mt -62.25 -42.12 99.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.092 -179.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -68.84 -54.21 17.01 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.47 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 6.4 mmtt -50.81 -31.85 18.26 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.106 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 720' ' ' GLU . . . . . 0.402 ' O ' ' HG2' ' A' ' 723' ' ' MET . 13.1 mt-10 -70.96 -55.5 8.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.497 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 35.4 t -63.2 -54.84 27.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.872 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -52.9 -41.11 64.08 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.942 -179.263 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 723' ' ' MET . . . . . 0.402 ' HG2' ' O ' ' A' ' 720' ' ' GLU . 15.4 ptp -73.92 -40.72 62.91 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.066 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -54.54 -40.73 68.95 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.312 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 725' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.13 -37.56 18.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.289 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.65 -57.28 8.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.875 0.369 . . . . 0.0 111.029 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 727' ' ' ILE . . . . . . . . . . . . . 4.1 mp -88.19 11.64 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.676 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 1.8 tt -52.22 -41.63 62.89 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.827 0.346 . . . . 0.0 111.159 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -76.4 -59.91 2.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.934 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 13.2 mtmt . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.236 -0.888 . . . . 0.0 110.891 -179.966 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.166 0 N-CA-C 112.513 -0.235 . . . . 0.0 112.513 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -52.38 -29.71 40.25 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.616 2.211 . . . . 0.0 112.31 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.2 mt -79.33 -178.1 6.06 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.9 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 140.47 67.65 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.467 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 32.5 t -133.44 31.62 3.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.788 0.327 . . . . 0.0 110.876 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 12.0 mt -91.31 -176.6 4.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.891 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 109.0 104.06 2.88 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.538 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -135.44 121.52 20.06 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 121.246 0.546 . . . . 0.0 110.763 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.27 136.74 40.06 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.026 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 619' ' ' TRP . . . . . 0.444 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.0 OUTLIER -60.81 -18.48 55.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.248 179.995 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 124.41 165.24 12.14 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.484 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -68.0 -35.38 20.5 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 122.575 2.184 . . . . 0.0 112.222 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 11.0 p30 -66.65 -39.36 88.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.852 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 623' ' ' VAL . . . . . 0.444 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 41.2 t -72.95 -40.84 60.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.77 179.613 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -58.0 -41.42 83.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.641 179.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.03 -47.7 67.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.67 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 5.6 tt -62.22 -32.92 73.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.004 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -73.92 -50.01 22.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.273 -179.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.08 -47.14 81.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.056 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 12.1 mt -65.42 -41.22 90.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.046 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 9.4 ttpt -61.7 -50.98 70.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.797 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 7.2 tttm -56.58 -41.0 76.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.168 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 632' ' ' HIS . . . . . 0.468 ' CE1' HD12 ' A' ' 709' ' ' LEU . 80.7 t60 -70.97 -43.29 68.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.309 -179.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . 0.425 HD23 ' CD2' ' A' ' 702' ' ' TYR . 48.1 mt -56.28 -48.01 77.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.166 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 38.3 ptt180 -66.04 -41.07 91.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.813 0.34 . . . . 0.0 110.626 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.76 -11.56 60.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.184 179.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -98.74 -7.73 27.2 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.605 -0.271 . . . . 0.0 111.659 -179.606 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 115.52 -0.01 21.89 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.508 -0.853 . . . . 0.0 112.542 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 638' ' ' ILE . . . . . 0.425 HG23 ' CZ ' ' A' ' 702' ' ' TYR . 14.5 mt -109.4 104.71 17.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.662 0.268 . . . . 0.0 111.223 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.92 113.55 15.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.829 0.347 . . . . 0.0 110.964 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 2.0 ttp -123.73 31.49 5.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.859 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.7 -33.72 71.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.934 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 18.4 mt-10 -70.28 -78.33 0.07 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.893 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -177.59 132.53 0.34 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.877 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -79.67 135.3 11.47 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.531 2.154 . . . . 0.0 112.284 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 4.6 tp -129.09 152.42 48.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.237 0.542 . . . . 0.0 111.216 179.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 646' ' ' ILE . . . . . 0.419 ' CG2' ' HB3' ' A' ' 651' ' ' LEU . 4.2 tt -149.74 133.95 8.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.921 179.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.41 38.85 58.38 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.362 -0.923 . . . . 0.0 112.198 -179.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.14 8.01 64.18 Favored Glycine 0 C--N 1.332 0.335 0 C-N-CA 120.981 -0.628 . . . . 0.0 113.71 179.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.3 m -134.38 164.18 28.01 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 117.341 0.571 . . . . 0.0 111.43 -179.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -79.98 146.0 32.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.833 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 651' ' ' LEU . . . . . 0.419 ' HB3' ' CG2' ' A' ' 646' ' ' ILE . 0.0 OUTLIER -134.54 144.93 48.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.381 -179.824 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -96.91 109.8 22.44 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.859 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 6.8 mp -54.17 -35.96 62.86 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.284 -179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -65.59 -43.47 89.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.109 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -73.01 -34.73 66.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.61 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 656' ' ' PHE . . . . . 0.436 ' CZ ' ' HG ' ' A' ' 682' ' ' LEU . 0.2 OUTLIER -70.92 -47.98 56.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.801 179.866 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -58.71 -52.81 64.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.098 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 2.6 ptm85 -59.1 -40.14 84.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.853 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . 0.418 HD23 ' CA ' ' A' ' 678' ' ' LEU . 0.6 OUTLIER -60.47 -48.78 80.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.332 -179.704 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 660' ' ' ILE . . . . . 0.418 ' CG2' ' HA ' ' A' ' 666' ' ' MET . 29.2 mt -56.71 -45.22 82.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-O 120.834 0.349 . . . . 0.0 110.561 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -63.96 -39.79 94.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.915 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -74.48 -13.9 60.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.486 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -94.24 36.63 1.13 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.716 0.294 . . . . 0.0 111.164 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 73.64 31.57 60.44 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.365 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 82.47 173.15 48.83 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.365 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 666' ' ' MET . . . . . 0.492 ' HE3' ' CZ ' ' A' ' 699' ' ' TYR . 0.0 OUTLIER -71.17 -40.55 71.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.738 0.304 . . . . 0.0 111.062 179.985 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -52.57 -43.77 65.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.453 -179.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 668' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.81 -40.86 95.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.935 0.398 . . . . 0.0 110.832 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 58.7 t -57.88 -55.82 19.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.434 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 670' ' ' THR . . . . . . . . . . . . . 8.8 t -75.98 -53.88 7.71 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -178.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -54.21 -50.97 65.88 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -178.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 25.0 mt -77.77 -1.75 32.95 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 -179.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 24.4 mttt 49.46 82.7 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 121.09 0.471 . . . . 0.0 110.433 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 40.0 mttt -146.31 22.47 1.34 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.926 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 675' ' ' TRP . . . . . 0.786 ' HB3' HD23 ' A' ' 695' ' ' LEU . 31.9 m95 -57.24 -31.02 65.11 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 121.445 0.64 . . . . 0.0 110.073 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -56.84 -40.79 76.72 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.411 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.52 -51.62 10.42 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 120.776 0.322 . . . . 0.0 111.409 -179.545 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.774 HD23 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -57.48 -37.4 72.86 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.591 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 679' ' ' ALA . . . . . 0.434 ' N ' ' CD2' ' A' ' 678' ' ' LEU . . . -71.48 -37.54 71.29 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.429 179.284 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -53.09 -46.29 68.57 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.314 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 35.0 mtp -65.24 -24.51 67.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.564 179.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 682' ' ' LEU . . . . . 0.436 ' HG ' ' CZ ' ' A' ' 656' ' ' PHE . 3.3 mm? -78.15 -2.07 35.73 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.535 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . 0.429 ' HB2' ' O ' ' A' ' 682' ' ' LEU . 1.6 mpp_? 68.68 71.79 0.28 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.883 0.373 . . . . 0.0 111.401 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . 0.437 HG21 ' HD2' ' A' ' 685' ' ' PRO . 1.9 mp -124.25 137.53 29.26 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.352 179.525 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . 0.437 ' HD2' HG21 ' A' ' 684' ' ' ILE . 24.8 Cg_endo -62.04 116.08 3.24 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.332 2.022 . . . . 0.0 112.298 -179.821 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -20.19 66.33 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.95 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 12.7 p -67.65 -23.87 65.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.204 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -64.64 111.02 2.55 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.986 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 19.9 mm-40 -83.06 4.85 24.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.559 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -121.78 -16.64 7.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.65 179.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 691' ' ' ARG . . . . . 0.473 ' O ' ' HB3' ' A' ' 695' ' ' LEU . 2.3 ppt_? -52.66 -32.07 40.37 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.473 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . 0.428 HD23 ' CD ' ' A' ' 691' ' ' ARG . 2.7 mm? -70.51 -54.54 11.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.729 0.299 . . . . 0.0 111.488 -179.785 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.78 -39.03 70.19 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.406 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.55 -37.36 87.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.979 0.419 . . . . 0.0 109.98 179.442 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . 0.786 HD23 ' HB3' ' A' ' 675' ' ' TRP . 3.9 tp -65.54 -47.76 74.77 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.854 179.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . 0.416 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 14.7 tt0 -55.19 -47.8 74.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.254 -179.621 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -77.2 -29.81 54.46 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.247 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . 0.417 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.78 -37.06 81.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.754 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 699' ' ' TYR . . . . . 0.492 ' CZ ' ' HE3' ' A' ' 666' ' ' MET . 1.4 p90 -86.28 -34.95 20.21 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.008 0.432 . . . . 0.0 110.361 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 700' ' ' CYS . . . . . . . . . . . . . 1.7 m -64.23 -30.57 71.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.784 179.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 25.0 tt0 -97.3 -3.44 40.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.451 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 702' ' ' TYR . . . . . 0.425 ' CZ ' HG23 ' A' ' 638' ' ' ILE . 5.6 m-85 -117.42 -78.59 0.58 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.824 0.345 . . . . 0.0 111.315 -179.716 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 77.9 mt -58.29 -45.78 87.32 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.532 -179.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.44 HD21 ' CE1' ' A' ' 699' ' ' TYR . 1.1 mm? -55.25 -49.05 73.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.919 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 2.2 m -54.68 -55.68 27.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.299 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 706' ' ' TYR . . . . . 0.441 ' HA ' ' CD2' ' A' ' 632' ' ' HIS . 14.3 t80 -47.44 -38.63 13.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.689 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -96.89 0.28 48.84 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -81.35 -19.71 42.19 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 709' ' ' LEU . . . . . 0.468 HD12 ' CE1' ' A' ' 632' ' ' HIS . 0.0 OUTLIER -92.27 -176.64 4.41 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.002 0.43 . . . . 0.0 111.458 -179.599 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 710' ' ' SER . . . . . 0.442 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.6 OUTLIER -84.7 168.59 20.19 Favored Pre-proline 0 C--N 1.331 -0.208 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.997 -179.804 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . 0.442 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 19.0 Cg_endo -59.01 -19.37 47.98 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.596 2.198 . . . . 0.0 112.569 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -59.36 -52.41 65.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.764 0.316 . . . . 0.0 110.73 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 713' ' ' GLU . . . . . 0.415 ' HB2' ' HG ' ' A' ' 709' ' ' LEU . 4.8 mm-40 -64.19 -25.69 68.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.842 179.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -74.42 -54.7 7.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.094 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.19 -34.78 79.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.394 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.08 -53.97 25.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.75 0.309 . . . . 0.0 111.045 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 43.8 mt -65.4 -36.73 84.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.055 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -71.7 -54.22 11.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.482 179.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 2.5 mmtm -54.55 -30.91 55.39 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.207 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 720' ' ' GLU . . . . . 0.419 ' O ' ' HG2' ' A' ' 723' ' ' MET . 3.4 mm-40 -71.56 -55.8 7.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.991 0.424 . . . . 0.0 110.508 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 42.3 t -62.8 -50.75 78.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.915 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 9.4 mp -56.93 -37.97 72.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.89 -179.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 723' ' ' MET . . . . . 0.419 ' HG2' ' O ' ' A' ' 720' ' ' GLU . 13.7 ptp -74.16 -39.13 63.46 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.26 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 724' ' ' GLU . . . . . 0.413 ' N ' ' HG3' ' A' ' 723' ' ' MET . 3.8 mt-10 -60.52 -31.0 70.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.057 -179.783 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 725' ' ' LYS . . . . . . . . . . . . . 9.5 pttt -86.09 -41.04 15.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.304 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -69.97 -50.6 40.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.155 -179.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 727' ' ' ILE . . . . . . . . . . . . . 4.2 mp -88.13 11.61 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.631 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 2.5 tt -57.8 -45.49 85.99 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.808 0.337 . . . . 0.0 111.058 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -60.7 -56.24 23.6 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.985 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 28.5 mtmt . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.878 -179.883 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 112.533 -0.227 . . . . 0.0 112.533 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -72.92 -35.11 5.8 Favored 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 122.591 2.194 . . . . 0.0 112.289 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 35.7 mt -65.25 159.99 22.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.963 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . -166.85 -51.85 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.408 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 61.25 94.66 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.817 0.341 . . . . 0.0 110.983 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 7.2 mt -100.35 -175.9 3.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.824 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -170.84 -104.77 0.18 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.59 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . 0.412 ' HG2' ' O ' ' A' ' 617' ' ' ARG . 0.0 OUTLIER -123.04 118.23 27.26 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-O 121.503 0.668 . . . . 0.0 110.879 -179.73 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.82 144.45 48.98 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.868 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 619' ' ' TRP . . . . . 0.448 ' CE2' ' HD2' ' A' ' 725' ' ' LYS . 0.1 OUTLIER -74.59 -7.05 51.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.43 179.969 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 116.63 158.25 11.24 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.438 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.81 -37.62 15.44 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.589 2.193 . . . . 0.0 112.048 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -67.73 -33.54 75.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.73 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 623' ' ' VAL . . . . . 0.439 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 60.5 t -70.15 -42.59 79.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.59 179.591 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 42.6 tp60 -62.92 -38.11 89.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.46 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.37 -49.63 74.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.395 179.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 9.8 tt -67.7 -28.55 67.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.828 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -73.86 -49.21 26.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.139 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -58.81 -48.15 82.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.026 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 20.5 mt -65.28 -38.84 83.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.984 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.02 -47.26 85.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.893 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -63.63 -40.22 96.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.984 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 632' ' ' HIS . . . . . 0.452 ' CE1' ' CD1' ' A' ' 709' ' ' LEU . 75.8 t60 -67.85 -42.89 80.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.858 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . 0.418 HD21 ' CD2' ' A' ' 702' ' ' TYR . 13.7 mt -56.58 -49.93 73.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.13 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -61.47 -41.54 97.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.67 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 11.8 t -73.56 -16.88 61.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.158 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -93.72 -9.58 37.23 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.57 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 119.95 -10.08 11.19 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.576 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 638' ' ' ILE . . . . . 0.431 HG21 ' CE2' ' A' ' 702' ' ' TYR . 3.3 mp -98.96 104.67 16.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.733 0.302 . . . . 0.0 111.114 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 1.2 m -77.18 113.12 14.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.889 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 1.9 mtp -128.37 31.01 5.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.887 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -62.89 -39.3 94.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.937 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -66.95 -77.83 0.07 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.001 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -176.43 140.96 0.53 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.839 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -78.23 147.95 23.71 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.604 2.203 . . . . 0.0 112.499 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 4.8 tp -141.36 150.9 43.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.201 0.524 . . . . 0.0 111.159 179.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 646' ' ' ILE . . . . . 0.405 ' CG2' ' HB3' ' A' ' 651' ' ' LEU . 0.8 OUTLIER -149.58 132.99 7.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.634 179.004 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.04 41.02 59.43 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.339 -0.934 . . . . 0.0 112.176 -179.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 69.96 6.91 58.14 Favored Glycine 0 C--N 1.333 0.373 0 C-N-CA 120.969 -0.634 . . . . 0.0 113.786 179.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.8 m -131.23 162.13 30.69 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 117.372 0.586 . . . . 0.0 111.512 -179.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -77.92 144.04 37.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.773 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 651' ' ' LEU . . . . . 0.405 ' HB3' ' CG2' ' A' ' 646' ' ' ILE . 0.0 OUTLIER -135.39 145.11 46.99 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.098 0.475 . . . . 0.0 111.296 -179.638 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -96.93 110.75 23.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.897 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -52.19 -30.15 25.72 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.976 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -71.69 -44.64 63.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.044 179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 4.2 t -69.36 -34.42 74.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.547 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 656' ' ' PHE . . . . . 0.4 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.2 OUTLIER -71.29 -47.02 59.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.778 179.847 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -56.83 -50.89 71.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.841 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 5.9 mtm180 -60.2 -41.63 93.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.718 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.66 -48.33 75.2 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.98 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 660' ' ' ILE . . . . . 0.492 ' CG2' ' HA ' ' A' ' 666' ' ' MET . 14.0 mt -59.94 -44.64 94.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.827 179.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 13.4 t30 -61.02 -44.43 97.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.888 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -67.14 -13.95 62.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.352 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 36.5 mmm -94.57 36.49 1.16 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.776 0.322 . . . . 0.0 111.102 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 65.04 44.24 94.64 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.588 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 81.51 172.73 47.21 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.549 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 666' ' ' MET . . . . . 0.492 ' HA ' ' CG2' ' A' ' 660' ' ' ILE . 0.0 OUTLIER -73.01 -31.66 64.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.744 0.307 . . . . 0.0 111.123 179.919 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 667' ' ' GLN . . . . . 0.405 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 12.6 pt20 -56.94 -44.09 82.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.185 -179.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 668' ' ' GLN . . . . . 0.41 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -64.87 -52.15 58.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.956 0.408 . . . . 0.0 110.842 -179.901 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 80.4 t -49.25 -55.77 3.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.619 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 670' ' ' THR . . . . . 0.415 ' HB ' ' CE ' ' A' ' 666' ' ' MET . 14.5 t -76.28 -50.29 14.76 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -178.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 671' ' ' ASP . . . . . 0.405 ' CB ' ' O ' ' A' ' 667' ' ' GLN . 6.1 t0 -63.32 -51.25 66.79 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -177.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 672' ' ' LEU . . . . . 0.41 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 10.5 mp -76.68 2.68 13.48 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -178.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 48.89 85.62 0.03 OUTLIER 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.987 0.423 . . . . 0.0 110.494 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -147.13 22.07 1.21 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.209 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 675' ' ' TRP . . . . . 0.75 ' CE3' HD22 ' A' ' 678' ' ' LEU . 38.1 m95 -60.15 -27.47 67.11 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 121.358 0.599 . . . . 0.0 110.16 179.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -55.44 -44.36 76.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.714 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 12.1 mttm -77.08 -51.6 10.76 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 120.748 0.309 . . . . 0.0 111.539 -179.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.75 HD22 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.43 -40.94 72.15 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 109.786 -0.449 . . . . 0.0 109.786 179.694 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 679' ' ' ALA . . . . . 0.405 ' N ' ' CD2' ' A' ' 678' ' ' LEU . . . -71.62 -35.06 70.33 Favored 'General case' 0 C--N 1.334 -0.073 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.828 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -53.21 -47.64 68.78 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.504 179.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -19.19 65.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.066 179.628 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 682' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -80.99 -2.8 49.35 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.632 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 73.68 71.88 0.12 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.869 0.366 . . . . 0.0 111.465 179.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . 0.441 HG22 ' HD2' ' A' ' 685' ' ' PRO . 3.2 mp -134.25 138.46 30.41 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.323 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . 0.441 ' HD2' HG22 ' A' ' 684' ' ' ILE . 28.1 Cg_endo -63.0 125.35 15.7 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.498 2.132 . . . . 0.0 112.763 -179.514 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -69.96 -23.9 63.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.023 179.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.36 -23.93 67.11 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.289 -179.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -71.34 109.16 5.17 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.826 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -70.79 -68.88 0.4 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.971 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -52.52 -18.53 1.75 Allowed 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 691' ' ' ARG . . . . . 0.42 ' HD3' HD22 ' A' ' 692' ' ' LEU . 0.0 OUTLIER -50.25 -33.96 21.48 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.795 0.331 . . . . 0.0 110.779 179.764 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . 0.42 HD22 ' HD3' ' A' ' 691' ' ' ARG . 4.3 mm? -70.27 -48.04 58.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.913 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.1 -38.41 69.36 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.316 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 2.7 tptt -61.71 -40.63 95.7 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.088 0.47 . . . . 0.0 110.117 179.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . 0.642 HD22 ' HB3' ' A' ' 675' ' ' TRP . 0.3 OUTLIER -66.89 -43.79 82.54 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.399 179.551 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . 0.476 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 5.2 tp60 -55.42 -46.91 76.63 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.76 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -77.18 -29.37 54.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.753 179.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . 0.429 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -68.1 -40.58 82.57 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.64 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 699' ' ' TYR . . . . . 0.498 ' CD2' ' CZ2' ' A' ' 675' ' ' TRP . 0.7 OUTLIER -84.16 -31.13 25.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.955 0.407 . . . . 0.0 110.657 -179.94 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 700' ' ' CYS . . . . . 0.43 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 41.7 t -67.69 -30.4 69.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.877 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -101.14 -1.78 33.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.787 -179.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 702' ' ' TYR . . . . . 0.431 ' CE2' HG21 ' A' ' 638' ' ' ILE . 4.3 m-85 -115.55 -78.85 0.58 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.809 0.337 . . . . 0.0 111.7 -179.508 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 2.7 tp -63.2 -38.85 92.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.829 -179.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.43 ' HB2' ' O ' ' A' ' 700' ' ' CYS . 0.6 OUTLIER -50.83 -56.66 11.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.471 -179.557 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 22.7 p -54.42 -49.32 70.23 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.173 -179.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 706' ' ' TYR . . . . . . . . . . . . . 10.5 t80 -62.36 -29.14 70.25 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.345 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -96.8 -1.27 46.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.823 -179.563 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 1.5 t -112.31 -18.18 12.56 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.603 0.239 . . . . 0.0 111.501 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 709' ' ' LEU . . . . . 0.452 ' CD1' ' CE1' ' A' ' 632' ' ' HIS . 0.2 OUTLIER -74.09 175.19 7.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.759 0.314 . . . . 0.0 110.992 -179.918 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.44 166.15 47.4 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.228 -179.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -67.94 -27.45 36.69 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.646 2.23 . . . . 0.0 112.119 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -52.2 -50.51 61.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.633 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 713' ' ' GLU . . . . . 0.445 ' HB2' ' CD1' ' A' ' 709' ' ' LEU . 3.3 mm-40 -58.08 -26.6 62.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.193 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 714' ' ' HIS . . . . . 0.421 ' CD2' HD22 ' A' ' 709' ' ' LEU . 5.6 m170 -75.88 -53.62 8.17 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.935 0.398 . . . . 0.0 110.61 179.732 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 4.4 tpp180 -59.78 -45.32 92.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.385 -179.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -54.23 31.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.443 -179.452 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 71.2 mt -62.04 -44.06 97.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.816 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -64.72 -53.78 41.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.164 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 6.7 mmtt -50.15 -34.22 21.63 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.152 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 720' ' ' GLU . . . . . 0.411 ' O ' ' HG2' ' A' ' 723' ' ' MET . 1.1 mm-40 -68.16 -55.47 12.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.012 0.434 . . . . 0.0 110.404 179.521 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 31.3 t -62.84 -54.98 26.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.977 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 1.2 mp -49.0 -43.76 40.52 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.765 -179.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 723' ' ' MET . . . . . 0.411 ' HG2' ' O ' ' A' ' 720' ' ' GLU . 17.4 ptp -73.6 -41.31 63.01 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.456 -0.498 . . . . 0.0 109.792 179.416 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -57.37 -29.47 64.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.461 -179.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 725' ' ' LYS . . . . . 0.448 ' HD2' ' CE2' ' A' ' 619' ' ' TRP . 9.4 ptmm? -86.02 -38.88 17.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.329 -179.694 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -71.3 -49.92 37.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.017 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 727' ' ' ILE . . . . . . . . . . . . . 3.7 mp -88.36 11.45 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.629 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 1.6 tt -58.77 -49.48 77.49 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.824 0.345 . . . . 0.0 110.94 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -71.89 -46.1 58.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 10.3 mtpt . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.878 -179.965 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.234 0 N-CA-C 112.502 -0.239 . . . . 0.0 112.502 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -68.91 -27.96 30.03 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.589 2.193 . . . . 0.0 112.269 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 6.9 mt -66.26 168.21 9.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.92 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 73.4 44.98 31.81 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.487 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -158.27 60.54 0.45 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.859 0.361 . . . . 0.0 110.868 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 7.1 mt -77.63 170.91 15.75 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.869 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . 0.405 ' O ' ' HD3' ' A' ' 617' ' ' ARG . . . 111.76 70.59 0.59 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.492 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . 0.405 ' HD3' ' O ' ' A' ' 616' ' ' GLY . 76.2 mmt-85 -139.24 120.65 14.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.164 0.507 . . . . 0.0 110.572 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.7 126.28 5.6 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.927 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 619' ' ' TRP . . . . . 0.44 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.0 OUTLIER -63.09 -17.43 62.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.183 179.95 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 119.0 166.12 13.36 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.495 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -67.54 -36.49 19.64 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.508 2.139 . . . . 0.0 112.127 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -65.01 -42.17 94.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.842 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 623' ' ' VAL . . . . . 0.44 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 47.4 t -68.53 -37.09 77.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.926 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 6.3 tm0? -62.1 -41.81 98.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.8 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.64 -47.03 76.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.679 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 7.1 tt -67.07 -26.62 66.82 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.96 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -73.95 -54.06 8.74 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.363 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 30.8 p -57.92 -41.83 83.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.03 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 29.0 mt -69.28 -42.52 81.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.816 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.48 -43.87 98.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.765 179.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 1.6 tttm -63.01 -42.21 99.78 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.852 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 632' ' ' HIS . . . . . 0.452 ' CE1' ' CD1' ' A' ' 709' ' ' LEU . 77.8 t60 -67.41 -42.4 83.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.898 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 58.0 mt -55.9 -49.48 73.3 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.338 -179.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 634' ' ' ARG . . . . . 0.481 ' HG3' ' N ' ' A' ' 635' ' ' SER . 0.0 OUTLIER -64.22 -40.44 96.05 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.937 -179.972 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 635' ' ' SER . . . . . 0.481 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 0.1 OUTLIER -73.89 -16.09 61.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.142 179.765 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 636' ' ' GLN . . . . . 0.444 ' CG ' ' CE1' ' A' ' 632' ' ' HIS . 14.0 mm-40 -94.44 -10.23 33.07 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.564 -179.669 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 120.22 -11.97 10.58 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.573 -0.822 . . . . 0.0 112.522 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 638' ' ' ILE . . . . . 0.448 HG23 ' CE2' ' A' ' 702' ' ' TYR . 5.3 mp -94.25 104.7 16.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 120.668 0.27 . . . . 0.0 111.194 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.42 109.08 15.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.844 0.354 . . . . 0.0 110.994 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 1.4 mtp -119.13 28.89 7.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.891 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -66.68 -31.84 72.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.888 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -72.73 -78.61 0.09 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.878 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 1.3 pp -178.87 126.79 0.26 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.947 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -75.54 131.03 13.26 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.459 2.106 . . . . 0.0 112.274 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 4.1 tp -126.43 152.47 46.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.206 0.527 . . . . 0.0 111.13 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 646' ' ' ILE . . . . . 0.408 ' CG2' ' HB3' ' A' ' 651' ' ' LEU . 1.2 tt -149.57 133.26 8.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.832 179.174 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 54.15 38.87 62.27 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.239 -0.981 . . . . 0.0 111.93 -179.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.45 7.55 60.97 Favored Glycine 0 CA--C 1.52 0.389 0 C-N-CA 121.085 -0.579 . . . . 0.0 113.626 179.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 11.0 m -133.82 164.15 27.9 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 117.366 0.583 . . . . 0.0 111.557 -179.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -78.92 145.75 33.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.761 179.694 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 651' ' ' LEU . . . . . 0.408 ' HB3' ' CG2' ' A' ' 646' ' ' ILE . 0.0 OUTLIER -134.94 145.05 47.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.406 -179.745 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -96.9 111.76 23.82 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.984 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -53.06 -35.49 59.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.097 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -67.88 -46.19 72.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.231 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 4.7 t -69.15 -38.22 78.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.608 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 656' ' ' PHE . . . . . 0.467 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.3 OUTLIER -68.73 -47.25 66.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.892 179.813 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -60.33 -50.97 71.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.011 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -56.03 -43.44 77.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.102 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.68 -47.55 82.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.17 -179.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 660' ' ' ILE . . . . . 0.469 ' CG2' ' HA ' ' A' ' 666' ' ' MET . 24.7 mt -56.87 -45.09 83.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.8 0.333 . . . . 0.0 110.825 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -62.41 -44.97 95.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.726 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -66.84 -14.13 62.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.251 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.93 36.44 1.2 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.718 0.294 . . . . 0.0 110.979 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 68.97 35.65 79.51 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.658 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 84.02 172.46 48.94 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.542 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 666' ' ' MET . . . . . 0.472 ' HE1' ' CZ ' ' A' ' 699' ' ' TYR . 9.0 tpt -70.99 -28.94 64.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.66 0.267 . . . . 0.0 111.041 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 667' ' ' GLN . . . . . 0.442 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 12.4 pt20 -57.21 -43.74 83.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.25 -179.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 668' ' ' GLN . . . . . 0.423 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -66.63 -52.69 42.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.941 0.4 . . . . 0.0 110.913 179.979 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 53.2 t -49.37 -55.65 3.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.627 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 670' ' ' THR . . . . . 0.402 HG23 ' O ' ' A' ' 666' ' ' MET . 14.9 t -76.39 -48.89 18.26 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 113.857 1.058 . . . . 0.0 113.857 -178.474 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 671' ' ' ASP . . . . . 0.442 ' CB ' ' O ' ' A' ' 667' ' ' GLN . 17.5 t0 -65.65 -51.22 61.25 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -177.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 672' ' ' LEU . . . . . 0.423 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 8.7 mp -76.92 3.24 12.56 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 -179.154 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 49.22 84.47 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.962 0.41 . . . . 0.0 110.426 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 1.9 ttmt -144.72 21.86 1.63 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.263 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 675' ' ' TRP . . . . . 0.746 ' CE3' HD23 ' A' ' 678' ' ' LEU . 36.3 m95 -60.26 -28.52 68.13 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.369 0.604 . . . . 0.0 110.089 179.694 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -55.64 -44.51 77.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.643 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 1.7 ttpt -76.85 -51.55 11.09 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 120.704 0.287 . . . . 0.0 111.634 -179.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.746 HD23 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.56 -41.84 73.83 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 179.798 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 679' ' ' ALA . . . . . 0.406 ' CB ' ' NH2' ' A' ' 691' ' ' ARG . . . -71.48 -34.18 69.94 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-O 120.875 0.369 . . . . 0.0 110.521 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.34 -46.35 69.47 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.389 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 4.9 ttm -65.52 -21.05 66.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.837 179.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 682' ' ' LEU . . . . . 0.472 ' O ' ' HB2' ' A' ' 683' ' ' ARG . 2.7 mm? -79.96 -1.4 39.34 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.428 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . 0.472 ' HB2' ' O ' ' A' ' 682' ' ' LEU . 1.8 mpt_? 72.1 71.85 0.16 Allowed 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.959 0.409 . . . . 0.0 111.37 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . 0.439 HG23 ' HD2' ' A' ' 685' ' ' PRO . 3.1 mp -133.57 138.28 30.78 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.328 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . 0.439 ' HD2' HG23 ' A' ' 684' ' ' ILE . 21.7 Cg_endo -61.68 125.3 16.36 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.591 2.194 . . . . 0.0 112.679 -179.514 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.86 -26.03 64.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.954 179.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.52 -23.84 66.98 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.224 -179.817 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -68.96 109.15 3.8 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.916 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -71.74 -68.93 0.42 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.889 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -51.4 -21.28 2.2 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.771 -179.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 691' ' ' ARG . . . . . 0.406 ' NH2' ' CB ' ' A' ' 679' ' ' ALA . 0.0 OUTLIER -49.87 -35.22 22.6 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.881 0.372 . . . . 0.0 110.687 179.677 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -70.41 -47.21 61.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.074 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.13 -39.14 69.04 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.451 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 7.1 mttp -61.87 -41.32 97.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.09 0.471 . . . . 0.0 110.255 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . 0.7 HD22 ' HB3' ' A' ' 675' ' ' TRP . 0.4 OUTLIER -67.32 -43.91 80.46 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.471 179.784 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . 0.427 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 1.3 tt0 -55.24 -46.22 76.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.87 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -77.56 -29.69 52.31 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.074 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . 0.42 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.38 -39.25 85.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.544 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 699' ' ' TYR . . . . . 0.472 ' CE1' HD23 ' A' ' 704' ' ' LEU . 1.0 OUTLIER -84.99 -32.56 22.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.928 0.394 . . . . 0.0 110.512 179.881 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 700' ' ' CYS . . . . . 0.427 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 1.7 m -65.21 -30.28 71.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.714 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -100.91 -1.9 33.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.615 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 702' ' ' TYR . . . . . 0.448 ' CE2' HG23 ' A' ' 638' ' ' ILE . 4.8 m-85 -116.33 -79.59 0.59 Allowed 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 120.813 0.34 . . . . 0.0 111.524 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 1.6 tp -61.52 -40.51 94.89 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.722 -179.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.472 HD23 ' CE1' ' A' ' 699' ' ' TYR . 0.4 OUTLIER -48.31 -56.94 6.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.886 0.374 . . . . 0.0 111.429 -179.566 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 12.9 p -54.63 -47.33 73.61 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.383 -179.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 706' ' ' TYR . . . . . 0.485 ' CE1' ' CD2' ' A' ' 714' ' ' HIS . 10.2 t80 -66.13 -29.44 69.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.591 -179.503 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -96.71 -0.09 48.8 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 6.9 t -116.92 -15.77 10.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.541 0.21 . . . . 0.0 111.523 -179.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 709' ' ' LEU . . . . . 0.452 ' CD1' ' CE1' ' A' ' 632' ' ' HIS . 0.2 OUTLIER -73.96 175.14 7.65 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.751 0.31 . . . . 0.0 110.934 -179.949 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.41 164.51 59.14 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.958 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -66.5 -30.88 43.01 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.604 2.203 . . . . 0.0 111.961 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -48.94 -50.2 36.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.831 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 713' ' ' GLU . . . . . 0.433 ' HB2' ' CD1' ' A' ' 709' ' ' LEU . 3.5 mm-40 -58.26 -29.35 65.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.891 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 714' ' ' HIS . . . . . 0.485 ' CD2' ' CE1' ' A' ' 706' ' ' TYR . 1.8 m170 -75.76 -53.96 7.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.497 179.485 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 1.9 mtp-105 -60.22 -47.79 84.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.38 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.06 -54.05 40.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.553 -179.369 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 84.8 mt -62.89 -42.38 99.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.128 -179.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -67.37 -54.22 22.5 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.502 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -51.04 -33.66 26.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.323 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 720' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.42 -55.68 9.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.974 0.416 . . . . 0.0 110.563 179.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 23.3 t -63.44 -54.94 26.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.143 -179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -50.36 -43.29 54.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.779 -179.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 723' ' ' MET . . . . . 0.412 ' HG3' ' N ' ' A' ' 724' ' ' GLU . 13.4 ptp -72.12 -40.53 68.04 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.079 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 724' ' ' GLU . . . . . 0.412 ' N ' ' HG3' ' A' ' 723' ' ' MET . 2.2 mt-10 -52.41 -37.7 57.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.272 -179.727 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 725' ' ' LYS . . . . . 0.412 ' HD3' ' CZ2' ' A' ' 619' ' ' TRP . 0.0 OUTLIER -86.05 -45.71 11.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.227 -179.786 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -59.67 -55.75 30.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.199 -179.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 727' ' ' ILE . . . . . . . . . . . . . 4.2 mp -88.73 11.76 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.591 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 7.3 tt -48.93 -31.73 7.82 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.757 0.313 . . . . 0.0 111.213 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -61.09 -46.21 91.57 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.858 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.208 -0.901 . . . . 0.0 110.807 179.866 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.193 0 CA-C-O 120.143 -0.254 . . . . 0.0 112.487 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_exo -51.59 -44.65 42.76 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.425 2.084 . . . . 0.0 112.293 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.2 mp -79.67 165.16 23.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.873 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . -135.26 -141.53 4.4 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.498 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -96.8 79.1 2.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.861 0.363 . . . . 0.0 110.914 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 11.4 mt -128.3 175.73 8.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.863 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 117.91 -53.59 0.64 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.539 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 19.8 mmm180 -129.67 -145.97 0.3 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.371 -0.233 . . . . 0.0 110.371 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 5.1 mtp85 -61.95 121.49 13.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.781 0.324 . . . . 0.0 110.9 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 619' ' ' TRP . . . . . 0.434 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.1 OUTLIER -63.17 -16.82 61.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.347 -179.993 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 117.84 160.16 11.55 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.45 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -67.08 -33.73 30.81 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.57 2.18 . . . . 0.0 112.081 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -68.13 -34.8 77.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.813 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 623' ' ' VAL . . . . . 0.434 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 56.1 t -71.11 -45.32 72.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.582 179.576 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 624' ' ' GLN . . . . . 0.404 ' HG2' ' CD1' ' A' ' 722' ' ' LEU . 34.9 tp60 -59.47 -37.84 79.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.42 179.573 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.84 -50.75 69.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.256 179.431 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 9.3 tt -67.78 -28.69 67.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.712 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -72.03 -51.32 22.33 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.09 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.13 -47.85 80.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.935 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 38.8 mt -63.63 -37.58 80.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.828 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp -63.88 -47.52 80.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.79 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 5.3 tttm -60.28 -40.1 89.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.875 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 632' ' ' HIS . . . . . 0.454 ' CE1' ' CG ' ' A' ' 636' ' ' GLN . 73.7 t60 -70.87 -42.82 69.57 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.986 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . 0.415 HD22 ' CD2' ' A' ' 702' ' ' TYR . 20.1 mt -57.63 -50.06 74.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.222 -179.692 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 3.3 ptt85 -62.96 -44.12 96.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.817 0.341 . . . . 0.0 110.822 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.69 -11.56 60.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.221 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 636' ' ' GLN . . . . . 0.454 ' CG ' ' CE1' ' A' ' 632' ' ' HIS . 23.4 mm-40 -97.2 -7.84 31.43 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.572 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 111.89 6.75 24.32 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.375 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 638' ' ' ILE . . . . . . . . . . . . . 18.0 mt -117.03 107.86 23.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 CA-C-O 120.679 0.276 . . . . 0.0 111.318 -179.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -82.55 113.61 20.39 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.865 0.364 . . . . 0.0 110.791 179.743 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 2.0 ttp -124.15 35.45 4.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.883 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -69.53 -31.82 70.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.038 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -70.84 -79.01 0.07 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.971 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -178.97 135.02 0.29 Allowed Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.845 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -74.69 138.61 24.07 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.523 2.149 . . . . 0.0 112.29 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 5.0 tp -131.31 149.96 52.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.171 0.51 . . . . 0.0 111.134 179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 646' ' ' ILE . . . . . 0.413 ' CG2' ' HB3' ' A' ' 651' ' ' LEU . 1.2 tt -146.84 131.8 11.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.568 178.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 52.36 44.2 58.23 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.283 -0.961 . . . . 0.0 112.226 -179.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 66.27 8.7 45.65 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 120.925 -0.655 . . . . 0.0 113.773 179.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 33.3 m -131.15 161.95 30.99 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 117.374 0.587 . . . . 0.0 111.377 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -80.09 143.53 33.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.768 179.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 651' ' ' LEU . . . . . 0.413 ' HB3' ' CG2' ' A' ' 646' ' ' ILE . 0.0 OUTLIER -135.35 145.24 47.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.29 -179.692 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -97.33 110.79 23.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.886 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -52.14 -43.58 64.12 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.128 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -60.89 -43.31 98.63 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.153 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 1.6 t -66.5 -35.5 80.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.803 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 656' ' ' PHE . . . . . 0.417 ' CE1' ' HG ' ' A' ' 682' ' ' LEU . 0.1 OUTLIER -72.78 -43.61 62.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.938 -179.98 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -59.7 -46.62 88.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.854 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 37.8 mtp180 -63.57 -43.87 95.77 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.048 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.36 -49.55 77.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.359 -179.67 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 660' ' ' ILE . . . . . 0.45 ' CG2' ' HA ' ' A' ' 666' ' ' MET . 41.4 mt -56.83 -45.97 83.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.721 0.296 . . . . 0.0 110.889 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -66.88 -46.24 75.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.163 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -56.32 -21.38 23.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.548 -179.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.86 28.64 1.76 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.627 -0.26 . . . . 0.0 111.31 -179.765 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 90.49 -16.85 56.82 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.78 179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 135.79 179.43 16.6 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.32 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 666' ' ' MET . . . . . 0.504 ' HE2' ' CZ ' ' A' ' 699' ' ' TYR . 0.0 OUTLIER -72.64 -40.63 66.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.741 0.305 . . . . 0.0 111.199 -179.954 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 667' ' ' GLN . . . . . 0.4 ' O ' ' HB2' ' A' ' 671' ' ' ASP . 6.6 pm0 -51.13 -43.64 61.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.457 -179.548 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 668' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.8 -52.44 56.82 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.879 0.371 . . . . 0.0 110.925 -179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 89.5 t -49.33 -54.15 6.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.524 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 670' ' ' THR . . . . . . . . . . . . . 9.6 t -76.18 -54.3 7.01 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -178.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 671' ' ' ASP . . . . . 0.4 ' HB2' ' O ' ' A' ' 667' ' ' GLN . 69.7 m-20 -56.88 -51.18 70.09 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -177.88 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 7.9 mp -77.88 1.62 19.9 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -179.068 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 48.98 83.48 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.951 0.405 . . . . 0.0 110.439 -179.845 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 4.9 mtpm? -144.79 21.51 1.63 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.288 -179.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 675' ' ' TRP . . . . . 0.737 ' HB3' HD21 ' A' ' 695' ' ' LEU . 35.1 m95 -58.34 -29.16 65.72 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 121.338 0.589 . . . . 0.0 110.049 179.654 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -56.8 -41.27 77.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.676 -179.622 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 9.1 mttt -78.54 -51.95 9.2 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 120.774 0.321 . . . . 0.0 111.565 -179.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.727 HD22 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -56.77 -40.72 76.33 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 179.404 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 679' ' ' ALA . . . . . . . . . . . . . . . -71.94 -31.84 66.73 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.301 178.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.28 -48.18 68.53 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.038 179.379 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -62.04 -23.8 66.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.794 179.397 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 682' ' ' LEU . . . . . 0.488 ' O ' ' HB2' ' A' ' 683' ' ' ARG . 3.0 mm? -79.59 -2.42 42.42 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.507 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . 0.488 ' HB2' ' O ' ' A' ' 682' ' ' LEU . 6.3 mmm180 70.49 72.01 0.21 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.933 0.397 . . . . 0.0 111.443 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . 0.442 HG22 ' HD2' ' A' ' 685' ' ' PRO . 2.4 mp -128.52 141.78 42.63 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.456 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . 0.442 ' HD2' HG22 ' A' ' 684' ' ' ILE . 38.1 Cg_endo -68.16 121.33 8.31 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.261 1.974 . . . . 0.0 112.05 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -70.54 -25.08 62.94 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.432 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.37 -18.52 65.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.595 -179.515 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 688' ' ' ALA . . . . . 0.479 ' CB ' ' NE ' ' A' ' 691' ' ' ARG . . . -77.1 111.91 13.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.774 0.321 . . . . 0.0 111.425 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -83.17 -7.6 59.6 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.455 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -97.67 -27.58 14.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.148 0.499 . . . . 0.0 109.926 179.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 691' ' ' ARG . . . . . 0.479 ' NE ' ' CB ' ' A' ' 688' ' ' ALA . 0.3 OUTLIER -52.39 -46.72 66.38 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.32 -179.641 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -59.74 -46.2 89.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.299 -179.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.42 -39.49 67.87 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.823 0.344 . . . . 0.0 111.411 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.39 -41.93 93.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.453 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . 0.737 HD21 ' HB3' ' A' ' 675' ' ' TRP . 1.1 tp -64.7 -44.67 89.51 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.544 179.744 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . 0.438 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 2.2 mm-40 -55.55 -47.75 75.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.879 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -76.41 -29.45 57.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.211 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . 0.402 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.56 -37.1 82.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.721 -179.648 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 699' ' ' TYR . . . . . 0.504 ' CZ ' ' HE2' ' A' ' 666' ' ' MET . 1.3 p90 -85.38 -36.83 20.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.932 0.396 . . . . 0.0 110.394 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 700' ' ' CYS . . . . . . . . . . . . . 5.3 m -62.77 -30.47 71.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.546 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -95.89 -4.93 42.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.392 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 702' ' ' TYR . . . . . 0.415 ' CD2' HD22 ' A' ' 633' ' ' LEU . 6.8 m-85 -121.56 -75.47 0.59 Allowed 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.838 0.352 . . . . 0.0 111.257 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -54.01 -48.91 69.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.476 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.407 HD21 ' CE1' ' A' ' 699' ' ' TYR . 1.3 mm? -54.9 -29.57 56.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.099 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 24.5 m -69.74 -55.4 10.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.424 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 706' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -62.8 -29.57 70.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.931 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -85.5 -17.48 36.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.317 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 4.4 m -90.73 -21.91 21.35 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.84 0.352 . . . . 0.0 111.05 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 709' ' ' LEU . . . . . 0.522 ' HB3' ' HB2' ' A' ' 713' ' ' GLU . 60.6 mt -56.53 146.4 25.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.371 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 710' ' ' SER . . . . . 0.437 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.4 OUTLIER -79.39 167.67 32.56 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.607 179.732 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . 0.437 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 9.9 Cg_endo -53.15 -23.06 21.3 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.631 2.221 . . . . 0.0 112.401 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -70.18 -55.21 9.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.852 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 713' ' ' GLU . . . . . 0.522 ' HB2' ' HB3' ' A' ' 709' ' ' LEU . 1.6 mm-40 -63.2 -25.95 68.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.845 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 9.9 m-70 -75.68 -54.69 6.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.116 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -64.9 -38.04 89.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.14 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 33.3 ttt180 -68.19 -54.11 20.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.104 -179.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 35.0 mt -64.58 -37.61 88.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.802 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -71.24 -54.24 11.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.557 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 1.5 mmtt -52.4 -32.46 39.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.771 0.319 . . . . 0.0 111.191 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 720' ' ' GLU . . . . . 0.414 ' O ' ' HG2' ' A' ' 723' ' ' MET . 0.5 OUTLIER -70.02 -55.73 8.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.032 0.444 . . . . 0.0 110.468 179.652 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 21.7 t -63.43 -53.49 44.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.183 -179.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . 0.404 ' CD1' ' HG2' ' A' ' 624' ' ' GLN . 1.2 mp -53.12 -41.0 64.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.998 -179.352 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 723' ' ' MET . . . . . 0.414 ' HG2' ' O ' ' A' ' 720' ' ' GLU . 14.0 ptp -72.0 -38.75 69.6 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.101 179.745 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 40.7 mm-40 -57.33 -33.64 67.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.117 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 725' ' ' LYS . . . . . 0.432 ' HD2' ' CE2' ' A' ' 619' ' ' TRP . 0.0 OUTLIER -86.14 -38.83 17.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.367 -179.704 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -68.41 -50.18 54.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.841 0.353 . . . . 0.0 111.13 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 727' ' ' ILE . . . . . 0.407 ' CG2' ' O ' ' A' ' 727' ' ' ILE . 4.3 mp -88.2 11.47 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.551 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 3.4 tt -59.49 -35.43 74.11 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.867 0.365 . . . . 0.0 110.906 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -79.86 -71.07 0.47 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.991 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 13.1 ptmt . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.917 -179.903 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.206 0 N-CA-C 112.411 -0.276 . . . . 0.0 112.411 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -51.99 -28.56 32.5 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.535 2.157 . . . . 0.0 112.342 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 4.6 mp -62.94 169.51 3.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.927 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . -112.08 -120.35 3.85 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.49 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -98.79 31.42 2.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.815 0.34 . . . . 0.0 110.895 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 60.1 mt -68.47 -176.75 0.81 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.831 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 151.23 -52.38 0.5 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.52 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 5.0 mmm180 -109.94 -143.66 0.39 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.46 0.171 . . . . 0.0 110.593 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 60.8 mtt180 -56.27 137.79 51.62 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.864 0.364 . . . . 0.0 111.205 -179.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 619' ' ' TRP . . . . . 0.418 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.1 OUTLIER -72.78 -10.42 59.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.349 179.915 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 116.6 160.52 12.07 Favored Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.433 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -68.21 -39.03 10.97 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.541 2.161 . . . . 0.0 112.222 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 10.8 p30 -66.24 -34.22 77.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.885 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 623' ' ' VAL . . . . . 0.418 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 44.1 t -68.19 -45.65 82.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.712 179.669 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 624' ' ' GLN . . . . . 0.403 ' HG2' ' CD1' ' A' ' 722' ' ' LEU . 41.2 tp60 -60.95 -39.61 90.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.543 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.52 -50.82 72.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.57 179.702 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 6.7 tt -68.51 -29.71 68.36 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.871 179.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -70.24 -50.27 41.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.373 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.5 -37.1 85.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.346 -179.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 629' ' ' ILE . . . . . 0.449 ' HA ' ' CE1' ' A' ' 632' ' ' HIS . 38.7 mt -63.86 -54.01 37.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.327 -179.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 630' ' ' LYS . . . . . 0.426 ' HG3' ' N ' ' A' ' 631' ' ' LYS . 0.9 OUTLIER -61.69 -32.41 72.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.269 -179.71 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 631' ' ' LYS . . . . . 0.426 ' N ' ' HG3' ' A' ' 630' ' ' LYS . 1.8 tttm -63.1 -50.96 68.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.84 0.352 . . . . 0.0 111.329 -179.704 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 632' ' ' HIS . . . . . 0.463 ' CD2' ' N ' ' A' ' 633' ' ' LEU . 3.5 p-80 -68.31 -39.7 81.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.712 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . 0.463 ' N ' ' CD2' ' A' ' 632' ' ' HIS . 41.8 mt -56.82 -49.84 74.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.144 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 634' ' ' ARG . . . . . 0.456 ' HG3' ' N ' ' A' ' 635' ' ' SER . 11.8 ptt180 -64.08 -39.34 93.85 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.781 0.324 . . . . 0.0 110.615 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 635' ' ' SER . . . . . 0.456 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 75.1 m -73.61 -17.24 61.19 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.011 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.0 -7.17 46.59 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.466 -179.823 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 111.86 3.69 26.53 Favored Glycine 0 C--N 1.331 0.305 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.601 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 638' ' ' ILE . . . . . 0.421 HG21 ' CZ ' ' A' ' 702' ' ' TYR . 17.3 mt -109.66 104.85 17.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-O 120.694 0.283 . . . . 0.0 111.284 -179.413 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -78.05 129.82 35.7 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.952 0.406 . . . . 0.0 111.061 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -129.79 5.59 5.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.466 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -58.56 -26.76 63.91 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.742 0.306 . . . . 0.0 111.248 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -66.43 -80.8 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.953 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -177.11 118.52 0.26 Allowed Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.901 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -65.53 134.49 38.57 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.425 2.083 . . . . 0.0 112.432 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 4.6 tp -144.06 151.5 39.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.336 0.588 . . . . 0.0 111.441 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 646' ' ' ILE . . . . . 0.425 HD12 HD13 ' A' ' 695' ' ' LEU . 1.6 tt -149.65 133.49 8.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.228 -0.896 . . . . 0.0 109.705 178.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 52.65 40.73 56.08 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.302 -0.951 . . . . 0.0 112.218 -179.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.35 6.78 58.91 Favored Glycine 0 C--N 1.332 0.361 0 C-N-CA 120.986 -0.626 . . . . 0.0 113.839 179.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 6.3 m -132.08 163.04 29.34 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 117.413 0.606 . . . . 0.0 111.557 -179.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -78.94 144.27 34.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.727 179.77 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 651' ' ' LEU . . . . . 0.411 ' HB3' ' CG2' ' A' ' 646' ' ' ILE . 0.0 OUTLIER -134.86 144.99 47.86 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.249 -179.751 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -96.58 110.75 23.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.875 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -52.14 -32.68 36.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.163 -179.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -70.1 -44.41 69.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.166 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 14.4 t -69.1 -37.35 78.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.925 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 656' ' ' PHE . . . . . 0.434 ' CD2' HD13 ' A' ' 682' ' ' LEU . 0.3 OUTLIER -68.77 -45.9 70.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.884 -179.912 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -58.36 -49.77 76.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.981 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 1.8 mtt85 -60.04 -42.48 94.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.817 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.67 -50.45 73.14 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.307 -179.729 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 660' ' ' ILE . . . . . 0.466 ' CG2' ' HA ' ' A' ' 666' ' ' MET . 17.3 mt -56.71 -45.57 82.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.782 0.325 . . . . 0.0 110.841 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -63.47 -45.97 88.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.739 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -65.27 -19.97 66.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.2 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 8.9 mmm -90.2 36.67 0.88 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.477 -179.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 69.55 40.65 77.96 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.65 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 78.53 174.52 44.23 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.613 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 666' ' ' MET . . . . . 0.517 ' HE1' ' CZ ' ' A' ' 699' ' ' TYR . 0.0 OUTLIER -73.01 -34.66 66.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.803 0.335 . . . . 0.0 111.287 -179.981 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -54.67 -45.7 73.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.434 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 668' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -52.37 63.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.955 0.407 . . . . 0.0 110.774 179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 669' ' ' VAL . . . . . 0.404 ' HB ' ' HE3' ' A' ' 666' ' ' MET . 75.1 t -49.21 -55.75 3.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.777 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 670' ' ' THR . . . . . 0.413 ' HB ' ' CE ' ' A' ' 666' ' ' MET . 9.2 t -76.05 -51.65 11.84 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 -178.329 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -60.0 -51.2 70.67 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -177.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 10.7 mp -77.16 1.19 19.03 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -178.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 11.6 mtpp 49.36 87.21 0.03 OUTLIER 'General case' 0 CA--C 1.521 -0.163 0 CA-C-O 121.133 0.492 . . . . 0.0 110.385 -179.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -150.08 22.07 0.86 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.199 -179.678 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 675' ' ' TRP . . . . . 0.746 ' CE3' HD21 ' A' ' 678' ' ' LEU . 36.5 m95 -57.83 -28.49 64.13 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 121.444 0.64 . . . . 0.0 109.988 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -55.18 -42.65 73.5 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.608 -179.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.78 -51.64 10.19 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.677 0.275 . . . . 0.0 111.662 -179.337 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.746 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -56.46 -40.07 74.25 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.827 -0.435 . . . . 0.0 109.827 179.771 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 679' ' ' ALA . . . . . 0.415 ' N ' ' CD2' ' A' ' 678' ' ' LEU . . . -71.56 -35.64 70.67 Favored 'General case' 0 C--N 1.334 -0.079 0 CA-C-O 120.763 0.316 . . . . 0.0 110.567 179.199 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -53.03 -47.08 68.64 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.382 179.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 1.8 mtm -65.4 -22.51 66.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.872 179.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 682' ' ' LEU . . . . . 0.468 ' O ' ' HB2' ' A' ' 683' ' ' ARG . 3.5 mm? -78.97 -2.15 38.76 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.576 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . 0.468 ' HB2' ' O ' ' A' ' 682' ' ' LEU . 3.4 mtp180 71.44 72.03 0.17 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.945 0.402 . . . . 0.0 111.608 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . 0.436 HG22 ' HD2' ' A' ' 685' ' ' PRO . 3.2 mp -131.25 140.1 37.49 Favored Pre-proline 0 CA--C 1.532 0.262 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.282 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . 0.436 ' HD2' HG22 ' A' ' 684' ' ' ILE . 32.8 Cg_endo -64.85 123.24 11.35 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.52 2.147 . . . . 0.0 112.756 -179.464 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.97 -23.29 63.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.954 179.637 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.35 -23.73 67.06 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.272 -179.726 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -72.57 111.63 7.91 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.808 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -70.87 -68.83 0.41 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.952 -179.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -53.74 -15.71 1.37 Allowed 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -179.443 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 691' ' ' ARG . . . . . 0.428 ' HD3' HD21 ' A' ' 692' ' ' LEU . 0.0 OUTLIER -51.91 -35.28 44.94 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.79 0.329 . . . . 0.0 110.867 179.83 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . 0.428 HD21 ' HD3' ' A' ' 691' ' ' ARG . 3.5 mm? -70.37 -46.85 63.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.938 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.0 -37.85 69.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.236 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 2.9 mmtp -62.61 -39.91 95.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.087 0.47 . . . . 0.0 110.07 179.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . 0.658 HD22 ' HB3' ' A' ' 675' ' ' TRP . 0.4 OUTLIER -66.8 -44.67 80.62 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.44 179.609 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . 0.454 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 3.0 mt-30 -55.22 -46.17 75.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.757 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -77.23 -29.47 54.14 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.878 179.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . 0.418 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -68.94 -39.5 79.53 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.775 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 699' ' ' TYR . . . . . 0.517 ' CZ ' ' HE1' ' A' ' 666' ' ' MET . 0.7 OUTLIER -85.77 -31.33 22.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.937 0.398 . . . . 0.0 110.562 179.971 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 700' ' ' CYS . . . . . 0.444 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 8.6 m -68.14 -30.24 69.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.648 179.601 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.0 -1.25 43.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.411 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 702' ' ' TYR . . . . . 0.421 ' CZ ' HG21 ' A' ' 638' ' ' ILE . 6.1 m-85 -118.69 -78.67 0.59 Allowed 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.871 0.367 . . . . 0.0 111.35 -179.739 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.24 -42.02 90.11 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.712 -179.243 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.448 HD22 ' CE1' ' A' ' 699' ' ' TYR . 0.6 OUTLIER -55.21 -41.61 72.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.874 0.369 . . . . 0.0 111.136 -179.71 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.45 -55.87 28.27 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.408 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 706' ' ' TYR . . . . . 0.434 ' HB2' ' CE1' ' A' ' 632' ' ' HIS . 3.1 t80 -56.34 -47.75 78.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.984 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -66.54 -18.57 65.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.133 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 24.9 p -91.36 -29.38 17.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.802 0.334 . . . . 0.0 110.904 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 709' ' ' LEU . . . . . . . . . . . . . 74.9 mt -61.32 157.56 16.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.902 179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -79.11 165.66 47.32 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.711 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -55.52 -22.36 34.58 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.482 2.121 . . . . 0.0 112.172 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -61.87 -54.31 43.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.903 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 713' ' ' GLU . . . . . . . . . . . . . 52.6 mm-40 -60.45 -26.38 66.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.109 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 16.4 m170 -75.98 -54.42 6.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.479 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 715' ' ' ARG . . . . . 0.446 ' HG3' ' N ' ' A' ' 716' ' ' ARG . 0.8 OUTLIER -62.56 -41.33 98.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.464 -179.451 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 716' ' ' ARG . . . . . 0.446 ' N ' ' HG3' ' A' ' 715' ' ' ARG . 0.2 OUTLIER -66.92 -54.0 26.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.844 0.354 . . . . 0.0 111.061 -179.654 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 59.9 mt -63.13 -41.24 99.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.969 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -69.17 -54.3 15.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.552 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.26 -32.35 24.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.167 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 720' ' ' GLU . . . . . 0.419 ' O ' ' HG2' ' A' ' 723' ' ' MET . 1.8 mt-10 -70.17 -55.55 9.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.047 0.451 . . . . 0.0 110.402 179.633 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 20.0 t -62.59 -53.89 41.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.13 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . 0.403 ' CD1' ' HG2' ' A' ' 624' ' ' GLN . 1.1 mp -52.93 -41.3 64.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.046 -179.222 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 723' ' ' MET . . . . . 0.419 ' HG2' ' O ' ' A' ' 720' ' ' GLU . 15.2 ptp -72.97 -40.09 65.59 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.121 179.745 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -57.54 -31.31 65.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.321 -179.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 725' ' ' LYS . . . . . 0.416 ' HD3' ' CE2' ' A' ' 619' ' ' TRP . 3.4 pttp -86.14 -39.83 16.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.402 -179.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -69.86 -51.89 29.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.24 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 727' ' ' ILE . . . . . . . . . . . . . 3.9 mp -87.7 11.63 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.733 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 3.0 tt -56.27 -42.41 77.39 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.82 0.343 . . . . 0.0 111.007 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -75.22 -54.11 7.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.948 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 1.2 mtmm . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.899 179.98 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.232 0 N-CA-C 112.492 -0.243 . . . . 0.0 112.492 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -68.98 -29.68 27.21 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.621 2.214 . . . . 0.0 112.305 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 5.5 mt -66.06 170.55 5.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.909 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 99.61 147.66 21.87 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.512 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 60.99 77.35 0.33 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.862 0.363 . . . . 0.0 110.922 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 3.4 mt -85.44 -178.69 6.77 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.813 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 152.58 110.09 0.43 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.634 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . 0.454 ' HG2' ' O ' ' A' ' 617' ' ' ARG . 0.0 OUTLIER -122.25 118.38 28.41 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 121.524 0.678 . . . . 0.0 110.625 179.869 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -103.93 137.24 42.2 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.069 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 619' ' ' TRP . . . . . 0.457 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.0 OUTLIER -74.89 -12.58 60.4 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.345 179.981 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 122.15 159.95 10.79 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.498 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -68.42 -32.68 25.01 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.555 2.17 . . . . 0.0 112.025 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -70.74 -33.51 70.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.702 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 623' ' ' VAL . . . . . 0.457 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 57.0 t -76.04 -41.65 38.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.34 179.153 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 7.8 tm0? -59.36 -40.45 86.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.253 179.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.53 -50.93 63.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.301 179.399 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -57.83 -39.49 77.77 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.653 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -69.09 -52.59 26.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.282 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -56.92 -50.54 72.24 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.235 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 25.6 mt -59.29 -39.53 79.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.153 -179.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 7.0 ttpt -63.8 -49.64 72.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.919 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.32 -40.86 78.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.223 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 632' ' ' HIS . . . . . 0.485 ' CE1' ' CD1' ' A' ' 709' ' ' LEU . 85.6 t60 -71.67 -40.9 69.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.039 -179.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . 0.433 HD23 ' CE2' ' A' ' 702' ' ' TYR . 10.2 mt -56.83 -49.9 74.02 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.147 -179.74 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 1.5 ptt180 -65.71 -40.52 92.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.754 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 66.1 m -73.33 -13.74 61.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.25 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 636' ' ' GLN . . . . . 0.401 ' NE2' ' CE1' ' A' ' 632' ' ' HIS . 0.1 OUTLIER -98.06 -4.74 35.32 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 -179.754 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 109.24 5.84 30.01 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.558 -0.83 . . . . 0.0 112.536 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 638' ' ' ILE . . . . . . . . . . . . . 18.1 mt -113.77 108.96 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-O 120.648 0.261 . . . . 0.0 111.277 -179.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -83.67 107.73 16.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.851 0.358 . . . . 0.0 110.913 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 640' ' ' MET . . . . . 0.405 ' HE1' ' HG3' ' A' ' 644' ' ' PRO . 1.6 ttp -117.09 35.14 4.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.817 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -74.61 -37.75 62.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.157 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -62.02 -82.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.052 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 1.7 pp -177.8 117.43 0.25 Allowed Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.949 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 644' ' ' PRO . . . . . 0.405 ' HG3' ' HE1' ' A' ' 640' ' ' MET . 31.7 Cg_exo -59.33 150.94 71.55 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.406 2.071 . . . . 0.0 112.241 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 4.7 tp -144.39 151.4 39.22 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.191 0.52 . . . . 0.0 111.405 179.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 646' ' ' ILE . . . . . 0.418 ' CG2' ' HB3' ' A' ' 651' ' ' LEU . 1.6 tt -149.81 133.87 8.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.688 178.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 52.57 40.12 54.6 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.34 -0.933 . . . . 0.0 112.282 -179.298 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.58 7.42 61.07 Favored Glycine 0 C--N 1.333 0.404 0 C-N-CA 120.964 -0.636 . . . . 0.0 113.658 179.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.7 m -131.99 162.35 30.92 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 117.346 0.573 . . . . 0.0 111.481 -179.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -77.77 143.84 37.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.825 179.809 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 651' ' ' LEU . . . . . 0.418 ' HB3' ' CG2' ' A' ' 646' ' ' ILE . 0.0 OUTLIER -135.42 145.4 47.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.066 0.46 . . . . 0.0 111.426 -179.588 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -99.18 112.36 24.53 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.754 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -52.64 -39.06 61.4 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.008 -179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -64.14 -43.73 94.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.003 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 4.2 t -67.57 -39.67 84.91 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.043 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 656' ' ' PHE . . . . . 0.435 ' CD2' ' CD1' ' A' ' 682' ' ' LEU . 0.7 OUTLIER -67.44 -42.74 82.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.708 -179.983 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -59.7 -45.9 90.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.805 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 3.8 mtm180 -63.04 -43.21 99.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.538 179.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.16 -51.45 69.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.966 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 660' ' ' ILE . . . . . 0.421 HG12 ' CD1' ' A' ' 678' ' ' LEU . 67.7 mt -57.68 -45.55 86.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.858 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -59.79 -39.69 85.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.82 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -61.15 -21.73 64.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.151 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 663' ' ' MET . . . . . 0.401 ' CE ' ' HB3' ' A' ' 678' ' ' LEU . 0.0 OUTLIER -88.47 14.38 9.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.627 -179.769 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 86.11 17.63 60.73 Favored Glycine 0 C--N 1.332 0.358 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.926 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 111.49 169.87 18.79 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.592 -0.813 . . . . 0.0 112.71 179.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 666' ' ' MET . . . . . 0.42 ' HE3' ' CE1' ' A' ' 699' ' ' TYR . 0.0 OUTLIER -63.83 -31.93 73.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.768 0.318 . . . . 0.0 111.046 -179.972 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -55.6 -48.19 75.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.443 -179.573 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 668' ' ' GLN . . . . . . . . . . . . . 8.0 mm-40 -62.24 -52.59 63.13 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.842 0.354 . . . . 0.0 111.136 -179.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 60.7 t -50.92 -55.89 5.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.944 -179.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 670' ' ' THR . . . . . 0.414 ' CG2' ' N ' ' A' ' 671' ' ' ASP . 10.8 t -76.17 -53.07 8.82 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 -178.297 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 671' ' ' ASP . . . . . 0.414 ' N ' ' CG2' ' A' ' 670' ' ' THR . 4.4 t70 -57.32 -51.07 70.86 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -177.722 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 9.1 mp -78.7 2.3 20.07 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -178.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 3.8 mmtp 48.27 86.09 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.076 0.465 . . . . 0.0 110.517 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -149.15 21.68 0.96 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.147 -179.855 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 675' ' ' TRP . . . . . 0.74 ' HB3' HD22 ' A' ' 695' ' ' LEU . 31.4 m95 -57.71 -28.4 63.82 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 121.327 0.584 . . . . 0.0 110.145 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -56.07 -42.05 76.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.853 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -77.49 -51.74 10.23 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 120.765 0.316 . . . . 0.0 111.665 -179.261 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.712 HD23 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -57.27 -40.55 77.96 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.677 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 679' ' ' ALA . . . . . . . . . . . . . . . -71.76 -33.63 68.81 Favored 'General case' 0 C--N 1.334 -0.082 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.412 178.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.16 -49.73 66.03 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.319 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 4.5 mtm -64.06 -22.37 66.9 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.867 179.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 682' ' ' LEU . . . . . 0.435 ' CD1' ' CD2' ' A' ' 656' ' ' PHE . 2.5 mm? -78.41 -3.34 42.77 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.526 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . 0.418 ' HB2' ' O ' ' A' ' 682' ' ' LEU . 23.9 mmt85 70.56 71.92 0.2 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.898 0.38 . . . . 0.0 111.546 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . 0.415 HG23 ' HD2' ' A' ' 691' ' ' ARG . 2.1 mp -123.0 142.43 38.14 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.158 179.436 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.86 119.12 6.12 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.499 2.133 . . . . 0.0 112.634 -179.674 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.96 -23.04 63.12 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.045 179.658 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.23 -22.5 66.88 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.463 -179.635 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 688' ' ' ALA . . . . . 0.477 ' O ' ' HG2' ' A' ' 691' ' ' ARG . . . -71.84 117.23 13.18 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.928 0.394 . . . . 0.0 111.075 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.25 3.82 29.61 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.37 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -121.69 -13.89 8.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.155 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 691' ' ' ARG . . . . . 0.477 ' HG2' ' O ' ' A' ' 688' ' ' ALA . 0.2 OUTLIER -55.0 -35.1 64.0 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.811 0.338 . . . . 0.0 110.933 -179.673 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . 0.424 HD22 ' CD ' ' A' ' 691' ' ' ARG . 3.0 mm? -70.6 -47.69 58.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.042 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.93 -39.58 69.36 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.415 -179.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 3.8 mmtt -64.24 -40.78 96.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.241 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . 0.74 HD22 ' HB3' ' A' ' 675' ' ' TRP . 3.9 tp -63.89 -47.04 82.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.844 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . 0.416 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 0.0 OUTLIER -55.27 -49.09 72.96 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.189 -179.743 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -75.19 -29.49 60.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.126 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -68.54 -38.09 80.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.749 -179.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 699' ' ' TYR . . . . . 0.458 ' CD2' ' CZ2' ' A' ' 675' ' ' TRP . 1.0 OUTLIER -86.47 -30.52 21.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.831 0.348 . . . . 0.0 110.736 -179.877 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 700' ' ' CYS . . . . . . . . . . . . . 15.3 t -69.45 -30.51 68.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.644 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -97.46 -1.37 44.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.472 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 702' ' ' TYR . . . . . 0.433 ' CE2' HD23 ' A' ' 633' ' ' LEU . 7.1 m-85 -121.51 -78.64 0.6 Allowed 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.831 0.348 . . . . 0.0 111.316 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 1.1 mp -57.63 -44.55 85.66 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.523 -179.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.447 HD21 ' CE1' ' A' ' 699' ' ' TYR . 1.1 mm? -56.4 -49.41 74.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.86 0.362 . . . . 0.0 110.959 -179.801 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 22.7 m -54.7 -55.29 31.31 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.719 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 706' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -63.77 -29.35 70.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.202 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -79.0 -20.96 47.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.247 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 1.7 m -91.54 -17.59 25.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.283 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 709' ' ' LEU . . . . . 0.485 ' CD1' ' CE1' ' A' ' 632' ' ' HIS . 78.2 mt -58.62 153.12 17.01 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.914 0.387 . . . . 0.0 111.113 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 710' ' ' SER . . . . . 0.446 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.6 OUTLIER -79.06 168.46 26.78 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.473 179.619 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . 0.446 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 14.4 Cg_endo -56.8 -19.78 32.72 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.518 2.145 . . . . 0.0 112.524 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -67.49 -55.55 13.13 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.038 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 713' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -59.34 -26.17 64.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.075 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -75.83 -54.1 7.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.256 179.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 7.0 mtm180 -63.44 -40.82 98.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.428 -179.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.54 -54.08 27.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.755 0.312 . . . . 0.0 111.241 -179.598 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 57.8 mt -64.85 -39.39 93.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.975 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -69.29 -54.2 15.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.561 179.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 9.4 mmtt -52.89 -33.33 49.75 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.378 -179.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 720' ' ' GLU . . . . . 0.407 ' O ' ' HG2' ' A' ' 723' ' ' MET . 12.3 mt-10 -69.56 -55.76 9.23 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.079 0.466 . . . . 0.0 110.623 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 45.8 t -63.76 -53.33 45.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.15 -179.636 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 8.0 mp -54.4 -38.77 66.59 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.865 -179.173 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 723' ' ' MET . . . . . 0.407 ' HG2' ' O ' ' A' ' 720' ' ' GLU . 13.6 ptp -75.38 -40.61 57.82 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.033 179.605 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -54.32 -40.02 67.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.178 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 725' ' ' LYS . . . . . 0.444 ' HE2' ' CD2' ' A' ' 619' ' ' TRP . 0.0 OUTLIER -85.45 -42.64 14.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.097 -179.86 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -59.51 -53.46 57.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.949 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 727' ' ' ILE . . . . . . . . . . . . . 4.2 mp -89.37 11.7 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.551 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 1.7 tt -57.34 -45.56 84.2 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.853 0.359 . . . . 0.0 111.049 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -73.86 -54.71 7.37 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.979 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 6.9 mtmm . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.981 179.998 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.238 0 N-CA-C 112.504 -0.238 . . . . 0.0 112.504 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -68.01 -36.45 17.5 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.541 2.16 . . . . 0.0 112.346 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 3.3 mp -69.2 158.07 35.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.867 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . -76.32 76.97 1.42 Allowed Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.489 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -143.01 97.39 3.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.858 0.361 . . . . 0.0 110.866 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 11.8 mt -95.85 -176.27 3.67 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.924 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -114.22 58.54 0.43 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.536 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 34.7 mmt-85 -139.42 120.17 14.3 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 121.139 0.495 . . . . 0.0 110.657 179.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -176.18 134.77 0.26 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.83 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 619' ' ' TRP . . . . . 0.434 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.0 OUTLIER -62.29 -17.11 57.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.284 -179.97 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 126.11 163.21 11.49 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.491 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -68.52 -37.59 12.66 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.582 2.188 . . . . 0.0 112.241 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -67.35 -38.86 85.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.915 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 623' ' ' VAL . . . . . 0.434 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 40.1 t -70.98 -41.92 76.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.967 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 4.0 tm0? -58.6 -45.53 88.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.712 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 74.5 mtt-85 -62.18 -50.63 71.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.708 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 8.6 tt -61.51 -34.09 74.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.819 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -63.98 -53.76 45.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.185 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -58.97 -42.56 90.25 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.997 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 629' ' ' ILE . . . . . 0.448 ' HA ' ' CE1' ' A' ' 632' ' ' HIS . 38.3 mt -60.32 -51.39 73.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.048 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 4.7 ttpp -60.79 -32.82 72.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.249 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.67 -48.08 76.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.614 -179.507 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 632' ' ' HIS . . . . . 0.502 ' CD2' ' N ' ' A' ' 633' ' ' LEU . 3.3 p-80 -69.47 -39.84 77.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.921 -179.747 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . 0.502 ' N ' ' CD2' ' A' ' 632' ' ' HIS . 20.4 mt -55.86 -48.25 75.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.203 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 634' ' ' ARG . . . . . 0.426 ' HG3' ' N ' ' A' ' 635' ' ' SER . 0.1 OUTLIER -67.01 -39.92 87.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.719 0.295 . . . . 0.0 110.814 179.892 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 635' ' ' SER . . . . . 0.426 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 8.5 m -73.75 -14.03 61.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.42 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -97.39 -8.26 29.91 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 -179.675 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 118.83 -8.46 12.86 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.583 179.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 638' ' ' ILE . . . . . 0.429 HG22 ' CZ ' ' A' ' 702' ' ' TYR . 3.5 mp -99.5 104.65 16.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.744 0.307 . . . . 0.0 111.03 -179.636 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 3.2 m -80.57 114.12 19.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.885 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 1.8 ttp -122.6 27.85 7.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.932 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.46 -52.8 59.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.888 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -50.55 -72.39 0.05 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.23 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 179.67 134.4 0.25 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.81 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.13 122.96 7.47 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.455 2.103 . . . . 0.0 112.343 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 4.9 tp -125.73 153.39 44.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.305 0.574 . . . . 0.0 111.319 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 646' ' ' ILE . . . . . 0.412 ' CG2' ' HB3' ' A' ' 651' ' ' LEU . 2.2 tt -149.62 133.17 7.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.448 179.156 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 50.59 43.61 45.97 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.246 -0.978 . . . . 0.0 112.138 -179.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 68.58 6.19 48.31 Favored Glycine 0 CA--C 1.52 0.378 0 C-N-CA 121.127 -0.559 . . . . 0.0 113.991 179.304 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 4.0 m -131.27 162.79 29.24 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 117.68 0.74 . . . . 0.0 111.696 -178.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -81.25 142.42 33.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.743 179.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 651' ' ' LEU . . . . . 0.412 ' HB3' ' CG2' ' A' ' 646' ' ' ILE . 0.0 OUTLIER -134.11 144.76 48.78 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.071 0.462 . . . . 0.0 111.099 179.891 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.88 109.43 21.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.926 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -52.21 -42.62 63.69 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.083 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -62.78 -46.34 88.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.272 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 40.4 t -67.69 -37.58 82.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.911 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 656' ' ' PHE . . . . . 0.457 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.2 OUTLIER -68.82 -44.39 73.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.981 -179.898 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -59.96 -46.35 89.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.004 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.14 -43.89 98.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.009 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . 0.42 ' HA ' ' HG2' ' A' ' 662' ' ' GLU . 0.1 OUTLIER -56.7 -45.1 82.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.401 -179.65 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 660' ' ' ILE . . . . . 0.503 ' CG2' ' HA ' ' A' ' 666' ' ' MET . 37.2 mt -62.97 -44.47 99.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.264 -179.845 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -64.3 -45.2 89.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.641 -179.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . 0.42 ' HG2' ' HA ' ' A' ' 659' ' ' LEU . 18.3 pt-20 -66.36 -14.15 61.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.598 -179.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.67 34.7 1.45 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.803 0.335 . . . . 0.0 111.199 -179.784 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 73.89 32.86 58.41 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.827 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 85.54 172.59 49.07 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.606 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 666' ' ' MET . . . . . 0.508 ' HE3' ' CZ ' ' A' ' 699' ' ' TYR . 10.1 tpt -72.15 -28.87 63.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.643 0.259 . . . . 0.0 111.237 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 667' ' ' GLN . . . . . 0.406 ' O ' ' HB2' ' A' ' 671' ' ' ASP . 18.7 pt20 -55.07 -48.29 73.72 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.106 -179.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 668' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.0 -51.86 65.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.856 0.36 . . . . 0.0 110.812 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 40.7 t -49.19 -55.31 4.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.722 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 670' ' ' THR . . . . . . . . . . . . . 9.7 t -76.02 -50.69 14.12 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -178.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 671' ' ' ASP . . . . . 0.406 ' HB2' ' O ' ' A' ' 667' ' ' GLN . 40.0 m-20 -62.14 -51.27 68.55 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -177.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -78.0 3.55 14.47 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -179.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 1.7 mttt 49.07 86.43 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.996 0.427 . . . . 0.0 110.477 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 27.7 mttt -144.88 22.21 1.59 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.229 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 675' ' ' TRP . . . . . 0.78 ' CE3' HD23 ' A' ' 678' ' ' LEU . 36.6 m95 -61.21 -30.34 70.37 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 121.409 0.624 . . . . 0.0 110.173 179.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -57.02 -43.29 81.69 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.372 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.18 -51.52 11.96 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.802 0.334 . . . . 0.0 111.243 -179.615 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.78 HD23 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.84 -40.29 72.62 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.572 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 679' ' ' ALA . . . . . 0.413 ' N ' ' CD2' ' A' ' 678' ' ' LEU . . . -71.6 -33.68 69.23 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.551 179.107 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -53.77 -49.51 68.09 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.363 179.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 5.4 mtp -62.73 -22.21 66.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.763 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 682' ' ' LEU . . . . . 0.471 ' O ' ' HB2' ' A' ' 683' ' ' ARG . 3.2 mm? -79.28 -1.13 35.22 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.457 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . 0.471 ' HB2' ' O ' ' A' ' 682' ' ' LEU . 0.0 OUTLIER 70.63 71.93 0.2 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.956 0.408 . . . . 0.0 111.343 179.98 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . 0.417 HG23 ' HD2' ' A' ' 685' ' ' PRO . 1.8 mp -124.43 136.99 28.45 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.682 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . 0.417 ' HD2' HG23 ' A' ' 684' ' ' ILE . 36.8 Cg_endo -65.99 125.2 13.75 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.474 2.116 . . . . 0.0 112.361 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.85 -13.94 62.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.393 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.3 -23.18 66.95 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.734 0.302 . . . . 0.0 111.207 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 688' ' ' ALA . . . . . 0.414 ' CB ' ' HB2' ' A' ' 691' ' ' ARG . . . -82.81 107.6 15.55 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.949 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -75.09 -68.33 0.56 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.206 -179.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 70.8 m-20 -54.6 -17.36 3.21 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.811 -179.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 691' ' ' ARG . . . . . 0.414 ' HB2' ' CB ' ' A' ' 688' ' ' ALA . 0.0 OUTLIER -45.93 -40.51 10.31 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.876 0.369 . . . . 0.0 111.299 179.859 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -59.69 -42.06 92.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.056 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.23 -37.23 69.21 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.892 0.377 . . . . 0.0 111.159 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -65.11 -42.96 93.47 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.29 179.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . 0.761 HD21 ' HB3' ' A' ' 675' ' ' TRP . 0.4 OUTLIER -63.98 -43.91 94.31 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.422 179.67 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . 0.445 ' O ' ' CD1' ' A' ' 699' ' ' TYR . 5.1 tp60 -56.17 -44.82 79.71 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.643 179.76 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -77.22 -29.8 54.32 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.176 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . 0.445 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.39 -37.53 83.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.729 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 699' ' ' TYR . . . . . 0.512 ' CE2' HD22 ' A' ' 704' ' ' LEU . 2.1 p90 -84.92 -37.62 20.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.969 0.414 . . . . 0.0 110.232 179.646 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 700' ' ' CYS . . . . . 0.417 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 15.3 t -60.88 -30.32 70.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.646 179.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -100.09 -0.42 39.06 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.453 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 702' ' ' TYR . . . . . 0.445 ' CD1' ' O ' ' A' ' 698' ' ' ALA . 5.1 m-85 -117.69 -79.05 0.59 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.78 0.324 . . . . 0.0 111.623 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 5.9 mp -64.41 -40.35 95.61 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.951 -179.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.512 HD22 ' CE2' ' A' ' 699' ' ' TYR . 0.4 OUTLIER -47.44 -56.63 6.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.806 0.336 . . . . 0.0 111.515 -179.593 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.28 -46.12 72.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.251 -179.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 706' ' ' TYR . . . . . 0.456 ' HB2' ' CE1' ' A' ' 632' ' ' HIS . 10.2 t80 -61.95 -29.47 70.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.135 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -95.45 -4.46 45.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.497 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 8.6 p -112.52 -23.19 10.41 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.613 0.244 . . . . 0.0 111.378 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 709' ' ' LEU . . . . . 0.402 ' CD1' ' HB2' ' A' ' 713' ' ' GLU . 0.2 OUTLIER -70.15 172.61 7.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.812 0.339 . . . . 0.0 110.938 -179.942 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.6 165.57 51.86 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.098 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -68.42 -22.69 38.8 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.633 2.222 . . . . 0.0 112.191 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -52.3 -51.09 60.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.853 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 713' ' ' GLU . . . . . 0.402 ' HB2' ' CD1' ' A' ' 709' ' ' LEU . 1.6 mm-40 -57.96 -27.13 63.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.149 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 24.8 m-70 -76.03 -53.8 7.81 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.669 179.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.53 -46.61 88.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.56 -179.44 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 716' ' ' ARG . . . . . 0.4 ' CG ' ' N ' ' A' ' 717' ' ' LEU . 4.7 ptt180 -67.54 -51.57 49.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.797 -179.188 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . 0.4 ' N ' ' CG ' ' A' ' 716' ' ' ARG . 90.8 mt -64.57 -43.61 93.32 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.693 0.282 . . . . 0.0 111.072 -179.57 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -65.75 -54.17 30.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.242 179.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -50.46 -35.62 29.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.373 -179.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 720' ' ' GLU . . . . . 0.412 ' O ' ' HG2' ' A' ' 723' ' ' MET . 9.9 mt-10 -70.8 -55.47 8.49 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.933 0.397 . . . . 0.0 110.992 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 22.0 t -63.63 -55.17 24.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.168 -179.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -53.38 -42.37 66.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.999 -179.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 723' ' ' MET . . . . . 0.412 ' HG2' ' O ' ' A' ' 720' ' ' GLU . 14.1 ptp -68.66 -38.82 80.71 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 120.38 -0.528 . . . . 0.0 109.98 179.563 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -57.77 -35.02 70.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.157 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 725' ' ' LYS . . . . . 0.415 ' HD2' ' CE2' ' A' ' 619' ' ' TRP . 0.7 OUTLIER -86.11 -34.69 20.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.497 -179.654 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 726' ' ' GLU . . . . . 0.414 ' N ' ' HG3' ' A' ' 725' ' ' LYS . 10.3 mt-10 -72.37 -51.67 19.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.901 0.381 . . . . 0.0 111.189 -179.64 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 727' ' ' ILE . . . . . . . . . . . . . 4.2 mp -87.55 11.68 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.647 -179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 8.5 tp -55.23 -56.22 22.43 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.775 0.322 . . . . 0.0 111.261 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -56.92 -49.05 76.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.266 -179.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.324 -0.846 . . . . 0.0 110.905 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 112.533 -0.227 . . . . 0.0 112.533 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -70.03 -28.11 24.34 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.651 2.234 . . . . 0.0 112.285 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.13 163.14 13.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.883 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 89.04 107.71 1.11 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.461 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 2.8 m -147.88 101.88 3.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.894 0.378 . . . . 0.0 110.94 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 70.8 mt -108.94 -176.96 3.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.891 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -134.59 -79.84 0.13 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.555 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -121.47 -143.09 0.34 Allowed 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 110.572 -0.159 . . . . 0.0 110.572 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.3 149.06 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.91 0.386 . . . . 0.0 110.969 -179.861 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 619' ' ' TRP . . . . . 0.449 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.1 OUTLIER -98.82 -15.33 19.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.464 -179.831 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 118.22 166.45 13.74 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.49 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.31 -39.84 5.05 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.501 2.134 . . . . 0.0 112.363 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -63.78 -36.87 85.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.952 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 623' ' ' VAL . . . . . 0.449 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 48.6 t -68.64 -45.56 81.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.884 179.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 27.7 tp60 -59.65 -36.92 77.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.527 179.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 625' ' ' ARG . . . . . 0.42 ' HD3' ' CE2' ' A' ' 657' ' ' PHE . 0.1 OUTLIER -63.36 -50.79 68.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.509 179.694 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 6.3 tt -67.16 -27.5 67.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.921 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -73.47 -42.97 61.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.287 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.02 -34.92 73.9 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.176 -179.802 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 19.5 mt -68.94 -49.11 66.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.323 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.86 -35.8 81.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.932 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.52 -44.08 92.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.993 0.425 . . . . 0.0 110.702 179.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 632' ' ' HIS . . . . . 0.474 ' CG ' HD12 ' A' ' 709' ' ' LEU . 35.7 t60 -69.64 -41.63 75.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.806 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . 0.416 HD21 ' CD2' ' A' ' 702' ' ' TYR . 42.6 mt -57.14 -49.93 74.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.145 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.32 -43.5 98.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.709 179.793 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.58 -14.1 61.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.33 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -96.5 -8.18 32.76 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 111.649 0.241 . . . . 0.0 111.649 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 115.13 0.43 22.46 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.52 179.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 638' ' ' ILE . . . . . 0.426 HG21 ' CZ ' ' A' ' 702' ' ' TYR . 14.7 mt -109.41 104.93 17.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 120.766 0.317 . . . . 0.0 111.192 -179.494 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 1.3 m -83.28 104.14 13.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.048 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.28 25.96 5.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.818 179.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -78.06 -33.11 51.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.812 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -59.49 -73.4 0.09 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.84 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 179.13 118.41 0.21 Allowed Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.877 179.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.76 127.75 16.76 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.364 2.042 . . . . 0.0 111.967 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 4.3 tp -142.68 152.54 42.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.407 0.623 . . . . 0.0 111.836 -179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 646' ' ' ILE . . . . . 0.413 ' CG2' ' HB3' ' A' ' 651' ' ' LEU . 3.0 tt -149.86 133.53 8.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.552 178.772 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 51.59 41.75 50.25 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.223 -0.989 . . . . 0.0 112.222 -179.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.22 5.61 54.58 Favored Glycine 0 CA--C 1.521 0.466 0 C-N-CA 121.065 -0.588 . . . . 0.0 113.971 179.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.8 m -130.89 162.36 29.83 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 117.561 0.681 . . . . 0.0 111.66 -179.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -79.2 144.21 34.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.787 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 651' ' ' LEU . . . . . 0.443 ' HB2' ' CE1' ' A' ' 656' ' ' PHE . 0.0 OUTLIER -135.25 144.98 47.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.098 0.475 . . . . 0.0 111.433 -179.737 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.71 111.15 23.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.821 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -52.23 -43.41 64.27 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.146 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -59.25 -45.6 90.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.206 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 37.2 t -68.9 -33.9 74.53 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.756 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 656' ' ' PHE . . . . . 0.463 ' CE1' HD11 ' A' ' 682' ' ' LEU . 0.8 OUTLIER -68.54 -46.2 70.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.006 179.966 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 657' ' ' PHE . . . . . 0.42 ' CE2' ' HD3' ' A' ' 625' ' ' ARG . 75.7 t80 -60.82 -48.55 81.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.137 -179.816 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.13 -45.52 87.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.262 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.44 -51.0 71.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.547 -179.498 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 660' ' ' ILE . . . . . 0.449 ' CG2' ' HA ' ' A' ' 666' ' ' MET . 53.3 mt -56.75 -44.54 81.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.751 0.31 . . . . 0.0 110.831 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -62.6 -45.13 94.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.786 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -64.48 -14.99 59.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.355 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 1.7 mmm -94.21 28.06 2.64 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.704 0.288 . . . . 0.0 111.214 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 76.03 33.94 48.68 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.641 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 87.23 171.91 47.71 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.535 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 666' ' ' MET . . . . . 0.467 ' HE2' ' CZ ' ' A' ' 699' ' ' TYR . 10.7 tpt -70.73 -26.48 63.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.699 0.285 . . . . 0.0 111.218 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 667' ' ' GLN . . . . . 0.417 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 20.0 pt20 -58.3 -46.49 86.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.067 -179.79 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 668' ' ' GLN . . . . . 0.429 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 7.3 mm-40 -64.9 -52.75 54.77 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.901 0.382 . . . . 0.0 110.971 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 47.5 t -49.13 -55.89 3.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.816 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 670' ' ' THR . . . . . . . . . . . . . 12.6 t -76.23 -47.3 24.44 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -178.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 671' ' ' ASP . . . . . 0.417 ' CB ' ' O ' ' A' ' 667' ' ' GLN . 15.4 t0 -66.54 -51.14 59.76 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -177.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 672' ' ' LEU . . . . . 0.429 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 7.9 mp -76.08 1.93 14.24 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -179.08 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 6.1 tttp 49.87 84.2 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.024 0.44 . . . . 0.0 110.614 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.02 21.63 1.41 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.026 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 675' ' ' TRP . . . . . 0.748 ' HB3' HD22 ' A' ' 695' ' ' LEU . 31.1 m95 -59.16 -31.7 69.22 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.324 0.583 . . . . 0.0 110.219 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -54.56 -42.97 71.61 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.785 -179.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.97 -51.49 11.05 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 120.706 0.289 . . . . 0.0 111.565 -179.327 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.724 HD23 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.72 -42.52 75.41 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.813 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 679' ' ' ALA . . . . . 0.419 ' HB2' ' O ' ' A' ' 675' ' ' TRP . . . -71.64 -33.15 68.68 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 120.84 0.352 . . . . 0.0 110.589 179.037 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.23 -49.32 67.05 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.532 179.601 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 7.0 mtm -64.08 -21.12 66.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.856 179.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 682' ' ' LEU . . . . . 0.499 ' O ' ' HB2' ' A' ' 683' ' ' ARG . 2.9 mm? -78.96 -1.7 36.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.399 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . 0.499 ' HB2' ' O ' ' A' ' 682' ' ' LEU . 13.5 mmm180 73.17 71.7 0.13 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 121.0 0.428 . . . . 0.0 111.39 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . . . . . . . . . 2.7 mp -131.72 140.35 38.01 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.135 179.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -65.1 123.09 11.06 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.518 2.145 . . . . 0.0 112.68 -179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.79 -26.2 64.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.96 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 3.1 p -65.36 -21.6 66.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.095 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -71.8 111.08 6.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.871 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 25.7 mm-40 -71.67 -68.92 0.42 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.093 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -52.94 -19.21 2.42 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.909 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 691' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.4 -34.69 58.68 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.75 0.31 . . . . 0.0 110.726 179.753 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -70.33 -52.94 19.01 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.175 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -69.36 -36.48 76.9 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.357 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 2.0 tmmm? -63.81 -41.28 97.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.135 0.493 . . . . 0.0 110.003 179.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . 0.748 HD22 ' HB3' ' A' ' 675' ' ' TRP . 0.7 OUTLIER -63.37 -44.92 93.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.421 179.533 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . 0.42 ' O ' ' CD1' ' A' ' 699' ' ' TYR . 43.2 mt-30 -55.53 -44.82 77.06 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.744 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -77.34 -29.78 53.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.206 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . 0.409 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.12 -39.05 86.57 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.62 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 699' ' ' TYR . . . . . 0.467 ' CZ ' ' HE2' ' A' ' 666' ' ' MET . 1.7 p90 -83.77 -37.49 22.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.017 0.437 . . . . 0.0 110.244 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 700' ' ' CYS . . . . . 0.439 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 1.3 m -59.95 -31.71 70.12 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.485 179.708 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.53 -11.06 32.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.223 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 702' ' ' TYR . . . . . 0.426 ' CZ ' HG21 ' A' ' 638' ' ' ILE . 4.0 m-85 -114.44 -76.56 0.58 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.9 0.381 . . . . 0.0 111.405 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -54.66 -49.85 69.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.733 -179.361 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.453 HD22 ' CE2' ' A' ' 699' ' ' TYR . 0.5 OUTLIER -49.61 -45.45 48.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.851 0.357 . . . . 0.0 111.353 -179.607 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 2.3 m -55.38 -55.27 33.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.731 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 706' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -64.59 -30.42 71.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.018 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -78.6 -18.62 54.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.423 -179.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 1.7 t -93.13 -19.89 21.04 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.785 0.326 . . . . 0.0 110.97 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 709' ' ' LEU . . . . . 0.488 ' HB3' ' HB2' ' A' ' 713' ' ' GLU . 49.6 mt -51.48 141.51 15.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.555 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 710' ' ' SER . . . . . 0.439 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.5 OUTLIER -78.03 167.97 31.39 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.5 179.586 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . 0.439 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 9.2 Cg_endo -52.58 -22.91 18.05 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.517 2.145 . . . . 0.0 112.374 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -75.98 -55.89 5.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.982 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 713' ' ' GLU . . . . . 0.488 ' HB2' ' HB3' ' A' ' 709' ' ' LEU . 2.3 mm-40 -58.54 -27.26 64.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.021 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 8.7 m-70 -75.85 -53.96 7.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.432 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.05 -36.48 83.72 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.148 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.43 -54.36 21.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.827 0.346 . . . . 0.0 111.089 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 83.6 mt -64.42 -40.62 96.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.712 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -67.33 -54.03 24.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.398 179.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt -50.72 -35.01 29.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.315 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 720' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -67.77 -55.61 12.4 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.993 0.425 . . . . 0.0 110.544 179.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 33.2 t -63.75 -54.73 28.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.106 -179.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -49.06 -44.03 41.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.874 -179.31 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 723' ' ' MET . . . . . . . . . . . . . 16.9 ptp -72.77 -39.9 66.4 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.15 179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -50.86 -41.83 58.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.64 -179.305 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 725' ' ' LYS . . . . . 0.442 ' HG2' ' CZ2' ' A' ' 619' ' ' TRP . 0.0 OUTLIER -86.08 -36.82 19.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.686 0.279 . . . . 0.0 111.315 -179.751 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -62.48 -53.61 52.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.989 0.423 . . . . 0.0 110.945 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 727' ' ' ILE . . . . . 0.411 ' CG2' ' O ' ' A' ' 727' ' ' ILE . 4.6 mp -88.49 11.57 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.552 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 8.7 tt -56.79 -34.17 67.38 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.774 0.321 . . . . 0.0 110.995 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -90.53 -48.32 7.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.938 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 22.6 mtmt . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.852 -179.966 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.227 0 N-CA-C 112.471 -0.252 . . . . 0.0 112.471 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.73 -30.02 15.02 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.579 2.186 . . . . 0.0 112.347 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 2.7 mt -63.39 171.22 2.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.857 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 116.43 48.37 0.47 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.409 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 13.2 m -117.46 31.13 6.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.804 0.335 . . . . 0.0 110.909 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 3.2 mt -92.34 166.37 12.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.837 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -174.11 60.61 0.13 Allowed Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.476 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -83.98 -1.8 55.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.202 0.525 . . . . 0.0 111.505 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.92 139.99 43.7 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.858 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 619' ' ' TRP . . . . . 0.442 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.1 OUTLIER -57.49 -20.93 34.31 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.297 -179.975 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 123.55 164.96 12.17 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.329 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -65.64 -40.8 16.56 Favored 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 122.453 2.102 . . . . 0.0 112.191 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -59.85 -43.25 94.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.918 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 623' ' ' VAL . . . . . 0.442 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 38.3 t -71.54 -38.05 66.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.913 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -54.3 -45.39 72.54 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.661 179.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 8.3 mtt180 -70.68 -39.77 73.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.343 179.423 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -63.28 -32.27 73.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.768 179.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -72.9 -48.26 38.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.319 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -57.03 -46.56 82.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.951 -179.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 10.4 mt -66.38 -38.95 82.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.929 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 15.5 ttpt -64.22 -39.52 94.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.935 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.13 -42.41 89.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.817 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 632' ' ' HIS . . . . . 0.435 ' CD2' HD13 ' A' ' 709' ' ' LEU . 84.1 t60 -70.52 -41.44 72.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.796 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . 0.415 HD21 ' CD2' ' A' ' 702' ' ' TYR . 49.7 mt -58.27 -49.73 76.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.291 -179.718 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 634' ' ' ARG . . . . . 0.434 ' HG3' ' N ' ' A' ' 635' ' ' SER . 3.8 ptt180 -65.79 -38.77 89.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.983 -179.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 635' ' ' SER . . . . . 0.434 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 0.3 OUTLIER -73.71 -20.38 60.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.091 179.77 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 636' ' ' GLN . . . . . 0.423 ' CG ' ' CE1' ' A' ' 632' ' ' HIS . 32.4 mm-40 -88.93 -5.25 58.11 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.665 -179.661 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 109.97 -0.85 30.09 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.418 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 638' ' ' ILE . . . . . 0.408 HG21 ' CE2' ' A' ' 702' ' ' TYR . 13.9 mt -103.21 104.62 16.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 CA-C-O 120.703 0.287 . . . . 0.0 111.127 -179.612 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.11 108.43 17.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.899 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 1.6 mtp -119.87 28.6 8.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.864 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -60.99 -33.0 72.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.835 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -67.48 -78.62 0.06 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.904 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 178.06 129.81 0.21 Allowed Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.901 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.98 130.86 18.49 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.413 2.075 . . . . 0.0 112.223 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 4.4 tp -124.12 151.78 43.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.272 0.558 . . . . 0.0 111.455 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 646' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -149.66 132.9 7.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.614 178.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.21 40.95 60.69 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.304 -179.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.08 5.43 58.54 Favored Glycine 0 C--N 1.334 0.439 0 C-N-CA 120.989 -0.624 . . . . 0.0 113.875 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -132.26 163.79 27.83 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 117.447 0.624 . . . . 0.0 111.432 -179.115 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -79.29 145.74 33.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.822 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 651' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -135.69 145.05 46.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.11 0.481 . . . . 0.0 111.599 -179.57 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.91 112.33 24.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.97 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 6.7 mp -61.08 -33.78 73.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.076 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -64.58 -47.57 78.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.935 0.398 . . . . 0.0 110.942 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 53.3 t -70.34 -33.07 71.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.271 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 656' ' ' PHE . . . . . 0.46 ' CE2' ' HG ' ' A' ' 682' ' ' LEU . 0.3 OUTLIER -69.1 -46.28 68.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.569 179.624 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -58.17 -52.76 64.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.091 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -57.84 -41.34 82.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.823 0.344 . . . . 0.0 110.789 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.03 -46.0 75.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.124 179.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 660' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 656' ' ' PHE . 12.6 mt -63.2 -42.33 96.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.045 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -62.21 -46.15 90.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.114 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 71.4 tt0 -72.86 -9.54 58.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.474 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 1.4 mmm -95.03 36.66 1.19 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.765 0.317 . . . . 0.0 111.125 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 66.91 38.43 92.89 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.364 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 79.96 172.23 43.76 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.453 -179.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 666' ' ' MET . . . . . 0.497 ' HE1' ' CE2' ' A' ' 699' ' ' TYR . 9.7 tpt -72.15 -27.19 62.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.654 0.264 . . . . 0.0 111.256 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -57.53 -48.85 78.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.437 -179.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 668' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -63.19 -42.87 99.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.837 0.351 . . . . 0.0 111.296 -179.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 40.2 t -61.81 -53.35 49.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.785 -179.67 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 670' ' ' THR . . . . . 0.415 HG23 ' O ' ' A' ' 666' ' ' MET . 10.1 t -75.75 -49.66 17.53 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -178.615 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 51.2 m-20 -63.09 -51.01 68.28 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -178.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 22.6 mt -87.04 10.87 15.17 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 111.895 0.332 . . . . 0.0 111.895 -179.362 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 10.5 ttpp 46.67 77.19 0.09 Allowed 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 120.929 0.395 . . . . 0.0 110.506 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.52 6.71 14.74 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.706 -179.371 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 675' ' ' TRP . . . . . 0.805 ' HB3' HD11 ' A' ' 695' ' ' LEU . 77.1 m95 -65.05 -22.73 67.02 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.7 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -59.16 -51.68 68.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.845 0.355 . . . . 0.0 111.022 -179.519 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 5.1 tptt -78.0 -47.18 19.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.167 0.508 . . . . 0.0 110.193 179.402 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.655 ' CD2' ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -52.97 -46.41 68.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.176 179.297 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 679' ' ' ALA . . . . . 0.424 ' N ' HD21 ' A' ' 678' ' ' LEU . . . -71.27 -35.68 71.45 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.213 179.769 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -52.87 -48.08 67.37 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.778 0.323 . . . . 0.0 110.863 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 1.8 ttp -65.3 -20.69 66.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.861 179.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 682' ' ' LEU . . . . . 0.46 ' HG ' ' CE2' ' A' ' 656' ' ' PHE . 2.1 mm? -80.06 -3.43 48.54 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.523 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . 0.419 ' HB2' ' O ' ' A' ' 682' ' ' LEU . 0.5 OUTLIER 74.89 71.72 0.1 Allowed 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.936 0.398 . . . . 0.0 111.318 179.874 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . 0.403 HG23 ' HD2' ' A' ' 685' ' ' PRO . 1.8 mp -125.13 138.1 30.98 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.21 179.631 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . 0.403 ' HD2' HG23 ' A' ' 684' ' ' ILE . 41.1 Cg_endo -68.42 121.32 8.26 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.364 2.043 . . . . 0.0 112.567 -179.654 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 3.0 pptp? -69.76 -18.71 63.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.184 179.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.23 -20.47 66.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.299 -179.766 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 688' ' ' ALA . . . . . 0.412 ' O ' ' HG2' ' A' ' 691' ' ' ARG . . . -65.02 117.65 7.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.899 0.381 . . . . 0.0 110.87 179.778 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.13 7.83 14.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.557 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -138.84 -0.19 1.93 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.442 179.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 691' ' ' ARG . . . . . 0.459 ' O ' ' HB3' ' A' ' 695' ' ' LEU . 2.5 ptt180 -56.48 -33.94 66.45 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.764 0.316 . . . . 0.0 111.068 -179.585 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . 0.434 ' O ' ' CD2' ' A' ' 695' ' ' LEU . 0.5 OUTLIER -70.17 -53.09 18.67 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.927 0.394 . . . . 0.0 110.996 -179.943 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.98 -37.18 69.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.828 0.346 . . . . 0.0 111.565 -179.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.44 -41.29 98.67 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.361 -179.495 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . 0.805 HD11 ' HB3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -72.95 -40.01 65.73 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.969 -0.293 . . . . 0.0 110.654 179.972 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . 0.497 ' O ' ' CD1' ' A' ' 699' ' ' TYR . 0.0 OUTLIER -55.33 -44.6 76.02 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.29 0.567 . . . . 0.0 109.752 179.126 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -77.6 -29.46 51.92 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.754 179.075 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -66.78 -40.68 88.26 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.878 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 699' ' ' TYR . . . . . 0.497 ' CE2' ' HE1' ' A' ' 666' ' ' MET . 2.6 p90 -80.82 -40.4 25.02 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.833 0.349 . . . . 0.0 110.441 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 700' ' ' CYS . . . . . 0.417 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 0.7 OUTLIER -58.86 -33.03 70.0 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.784 179.909 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -94.4 -4.57 48.17 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.68 -179.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 702' ' ' TYR . . . . . 0.415 ' CD2' HD21 ' A' ' 633' ' ' LEU . 8.3 m-85 -123.3 -76.58 0.59 Allowed 'General case' 0 C--O 1.231 0.126 0 CA-C-O 120.791 0.329 . . . . 0.0 111.38 -179.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 25.5 mt -56.31 -45.95 80.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.488 -179.356 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.453 ' CD2' ' CE2' ' A' ' 699' ' ' TYR . 0.4 OUTLIER -47.62 -54.34 12.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.956 0.407 . . . . 0.0 111.284 -179.792 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 705' ' ' SER . . . . . 0.402 ' O ' ' HG ' ' A' ' 709' ' ' LEU . 0.1 OUTLIER -54.57 -48.34 72.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.97 -179.846 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 706' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -64.51 -31.61 72.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.052 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -79.57 -16.28 56.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.306 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -97.44 -19.75 18.22 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.771 0.319 . . . . 0.0 111.13 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 709' ' ' LEU . . . . . 0.435 HD13 ' CD2' ' A' ' 632' ' ' HIS . 45.7 mt -55.31 151.36 9.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.998 0.428 . . . . 0.0 111.466 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 710' ' ' SER . . . . . 0.412 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.3 OUTLIER -80.05 171.73 11.66 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.597 179.753 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . 0.412 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 60.1 Cg_endo -72.38 -6.75 19.67 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.494 2.129 . . . . 0.0 112.862 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -74.57 -56.62 4.63 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.854 0.359 . . . . 0.0 110.943 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 713' ' ' GLU . . . . . 0.419 ' CG ' ' HB3' ' A' ' 709' ' ' LEU . 2.8 pp20? -61.06 -25.79 67.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.033 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -73.23 -54.1 9.26 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.167 179.571 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 26.5 ttt180 -60.13 -40.69 90.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.11 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.47 -53.94 12.28 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.324 -179.702 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 76.8 mt -60.6 -43.26 97.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.863 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -63.86 -54.03 41.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.361 179.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 10.8 mmtt -50.38 -35.07 26.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.292 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 720' ' ' GLU . . . . . 0.413 ' O ' ' HG2' ' A' ' 723' ' ' MET . 1.5 mm-40 -70.39 -55.31 9.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.981 0.419 . . . . 0.0 110.93 179.866 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 39.2 t -63.77 -55.15 24.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.179 -179.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 7.1 mp -53.48 -41.94 66.75 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.1 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 723' ' ' MET . . . . . 0.413 ' HG2' ' O ' ' A' ' 720' ' ' GLU . 5.8 ptp -68.92 -38.83 79.79 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.052 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -59.68 -35.38 74.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.145 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 725' ' ' LYS . . . . . 0.422 ' HD3' ' CE2' ' A' ' 619' ' ' TRP . 10.0 pttt -86.15 -37.8 18.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.433 -179.663 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 726' ' ' GLU . . . . . 0.401 ' N ' ' HG3' ' A' ' 725' ' ' LYS . 3.5 mm-40 -70.11 -50.42 40.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.308 -179.524 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 727' ' ' ILE . . . . . 0.401 ' O ' ' CG2' ' A' ' 727' ' ' ILE . 4.1 mp -88.09 11.64 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.697 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 2.8 tt -57.68 -35.73 70.97 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.835 0.35 . . . . 0.0 110.952 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -63.04 -51.52 66.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.994 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 3.6 mtpt . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.18 -0.914 . . . . 0.0 110.927 -179.941 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.206 0 N-CA-C 112.457 -0.257 . . . . 0.0 112.457 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.59 -28.48 26.04 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.558 2.172 . . . . 0.0 112.291 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 3.1 mt -82.87 177.69 8.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.928 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 95.58 -24.38 29.63 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.608 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 29.2 t 62.91 79.88 0.25 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.806 0.336 . . . . 0.0 110.98 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 22.8 mt -68.19 174.31 4.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.862 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 85.3 74.33 1.26 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.506 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -84.12 -1.5 55.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.133 0.492 . . . . 0.0 111.429 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 5.6 mtp180 64.41 130.85 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.873 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 619' ' ' TRP . . . . . 0.481 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.0 OUTLIER -55.41 -22.53 20.5 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.275 -179.913 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 126.99 169.49 12.72 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.424 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -69.19 -33.65 18.27 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.589 2.193 . . . . 0.0 112.195 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -68.25 -43.34 78.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.849 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 623' ' ' VAL . . . . . 0.481 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 38.6 t -71.85 -39.58 67.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.897 179.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 1.9 tm0? -56.55 -50.39 72.03 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.868 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 6.9 mmm180 -64.44 -43.39 94.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.769 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 4.1 tt -59.65 -36.93 77.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.046 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -72.36 -45.8 58.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.365 -179.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.1 -47.11 81.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.167 -179.77 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 8.5 mt -65.74 -42.49 92.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.098 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.75 -45.16 91.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.169 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 2.1 tttp -59.8 -43.86 94.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.19 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 632' ' ' HIS . . . . . 0.444 ' CD2' ' HA ' ' A' ' 706' ' ' TYR . 86.3 t60 -68.91 -40.89 78.86 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.119 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 46.2 mt -57.49 -47.46 81.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.171 -179.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -64.14 -43.25 95.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.827 0.346 . . . . 0.0 110.605 179.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 20.2 m -73.67 -11.74 60.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.303 179.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 32.2 mm-40 -97.46 -9.6 26.93 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.654 -179.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 118.57 -8.7 13.25 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.268 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 638' ' ' ILE . . . . . 0.437 HG22 ' CE2' ' A' ' 702' ' ' TYR . 10.4 mt -100.57 104.64 16.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.649 0.261 . . . . 0.0 111.001 -179.78 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.82 109.49 15.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.086 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 1.6 mtm -113.64 25.15 11.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.82 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.98 -47.76 49.82 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.865 -179.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -49.59 -72.6 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.096 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -178.05 117.66 0.25 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.821 179.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -67.97 119.82 6.83 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.393 2.062 . . . . 0.0 112.097 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 4.4 tp -131.15 154.96 47.8 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.402 0.62 . . . . 0.0 111.651 -179.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 646' ' ' ILE . . . . . 0.409 ' CG2' ' HB3' ' A' ' 651' ' ' LEU . 2.3 tt -149.94 134.2 8.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.54 178.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 50.14 41.65 38.9 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.214 -0.993 . . . . 0.0 112.12 -179.343 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.16 5.74 54.74 Favored Glycine 0 CA--C 1.522 0.507 0 C-N-CA 121.025 -0.607 . . . . 0.0 113.812 179.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -131.82 162.54 30.32 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 117.553 0.677 . . . . 0.0 111.541 -179.089 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -81.38 144.33 31.52 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.85 179.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 651' ' ' LEU . . . . . 0.409 ' HB3' ' CG2' ' A' ' 646' ' ' ILE . 0.0 OUTLIER -134.78 145.07 48.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.191 179.988 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -95.27 110.41 22.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.883 -179.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -52.85 -36.07 58.35 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.025 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -69.31 -47.09 65.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.042 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 19.3 t -65.91 -41.78 91.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.629 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 656' ' ' PHE . . . . . 0.414 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.1 OUTLIER -67.37 -44.13 79.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.739 179.805 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -56.52 -51.71 67.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.885 179.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 11.2 ttt180 -58.58 -40.85 84.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.773 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.61 -45.62 77.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.102 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 660' ' ' ILE . . . . . 0.462 ' CG2' ' HA ' ' A' ' 666' ' ' MET . 33.0 mt -66.11 -44.27 91.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.265 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -61.25 -41.51 97.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.386 -179.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -72.3 -10.34 59.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.61 -179.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.74 36.58 1.38 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.76 0.314 . . . . 0.0 111.186 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 68.63 28.81 72.91 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.628 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 92.32 171.37 41.26 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.593 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 666' ' ' MET . . . . . 0.511 ' HE1' ' CZ ' ' A' ' 699' ' ' TYR . 10.6 tpt -71.59 -30.87 66.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.758 0.313 . . . . 0.0 111.254 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 667' ' ' GLN . . . . . 0.405 ' O ' ' HB2' ' A' ' 671' ' ' ASP . 7.4 pt20 -55.15 -44.92 75.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.139 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 668' ' ' GLN . . . . . 0.411 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -65.23 -52.19 56.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.898 0.38 . . . . 0.0 110.942 179.922 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 48.7 t -49.02 -54.75 4.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.592 -179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 670' ' ' THR . . . . . . . . . . . . . 12.9 t -76.22 -50.68 13.83 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 -178.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 671' ' ' ASP . . . . . 0.405 ' HB2' ' O ' ' A' ' 667' ' ' GLN . 70.0 m-20 -61.18 -51.18 70.09 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -177.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 672' ' ' LEU . . . . . 0.411 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 10.4 mp -76.22 1.62 15.42 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -178.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 2.9 mmmt 50.14 85.19 0.03 OUTLIER 'General case' 0 C--O 1.232 0.138 0 CA-C-O 121.042 0.448 . . . . 0.0 110.387 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 7.4 mtmt -147.88 19.88 1.14 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.209 -179.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 675' ' ' TRP . . . . . 0.705 ' HB3' HD23 ' A' ' 695' ' ' LEU . 26.4 m95 -55.77 -29.24 59.31 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-O 121.428 0.632 . . . . 0.0 110.199 179.816 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -57.34 -42.9 82.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.684 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 11.1 mmtp -76.32 -51.83 11.18 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 111.668 0.248 . . . . 0.0 111.668 -179.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.688 HD23 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -57.32 -41.3 79.68 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 179.528 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 679' ' ' ALA . . . . . 0.403 ' O ' ' HB2' ' A' ' 682' ' ' LEU . . . -71.72 -30.01 65.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.208 178.779 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.44 -51.56 66.53 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.295 179.57 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -60.53 -22.5 63.68 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.644 179.405 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 682' ' ' LEU . . . . . 0.403 ' HB2' ' O ' ' A' ' 679' ' ' ALA . 2.5 mm? -78.89 -2.2 38.74 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.445 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . 0.4 ' HB2' ' O ' ' A' ' 682' ' ' LEU . 1.1 mmt180 71.88 71.85 0.16 Allowed 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.962 0.41 . . . . 0.0 110.867 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . 0.43 HG23 ' HD2' ' A' ' 685' ' ' PRO . 1.7 mp -122.56 135.76 25.96 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.927 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . 0.43 ' HD2' HG23 ' A' ' 684' ' ' ILE . 37.4 Cg_endo -66.29 122.59 10.11 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.418 2.078 . . . . 0.0 112.3 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 1.5 mmtm -70.0 -17.28 63.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.245 179.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 1.1 p -65.46 -22.81 66.79 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.321 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -84.58 105.18 15.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.871 0.367 . . . . 0.0 110.905 179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 -70.49 -68.46 0.43 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.181 -179.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -52.76 -19.55 2.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.871 -179.583 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 691' ' ' ARG . . . . . 0.418 ' NH2' ' CG1' ' A' ' 684' ' ' ILE . 0.0 OUTLIER -48.09 -37.1 14.45 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.856 0.36 . . . . 0.0 111.171 179.922 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -64.23 -42.97 96.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.006 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.05 -36.78 69.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.971 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 3.5 tttt -65.67 -41.69 92.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.128 179.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . 0.705 HD23 ' HB3' ' A' ' 675' ' ' TRP . 0.2 OUTLIER -64.59 -41.93 95.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.279 179.51 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . 0.461 ' O ' ' CD1' ' A' ' 699' ' ' TYR . 0.0 OUTLIER -57.85 -44.16 86.36 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.663 179.706 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -77.37 -29.79 53.47 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.128 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . 0.437 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.39 -37.68 83.49 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.716 -179.7 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 699' ' ' TYR . . . . . 0.511 ' CZ ' ' HE1' ' A' ' 666' ' ' MET . 2.1 p90 -84.26 -39.06 19.73 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.945 0.402 . . . . 0.0 110.305 179.689 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 700' ' ' CYS . . . . . . . . . . . . . 13.7 t -60.03 -30.54 69.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.567 179.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -97.89 -3.49 38.49 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.451 179.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 702' ' ' TYR . . . . . 0.437 ' CE2' HG22 ' A' ' 638' ' ' ILE . 5.3 m-85 -117.98 -74.94 0.59 Allowed 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.862 0.363 . . . . 0.0 111.278 -179.719 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 1.1 mp -60.91 -46.8 89.21 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.677 -179.263 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -52.76 -50.76 62.86 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.925 0.393 . . . . 0.0 111.072 -179.812 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 705' ' ' SER . . . . . 0.462 ' O ' HD11 ' A' ' 709' ' ' LEU . 0.3 OUTLIER -54.6 -54.84 36.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.719 179.935 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 706' ' ' TYR . . . . . 0.497 ' CE2' ' CE1' ' A' ' 714' ' ' HIS . 23.8 t80 -47.18 -43.12 20.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.97 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -93.79 -0.82 55.67 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.06 -16.43 56.8 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.453 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 709' ' ' LEU . . . . . 0.462 HD11 ' O ' ' A' ' 705' ' ' SER . 0.0 OUTLIER -95.71 -173.35 2.84 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.833 0.349 . . . . 0.0 111.51 -179.642 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 710' ' ' SER . . . . . 0.408 ' O ' HD22 ' A' ' 709' ' ' LEU . 0.3 OUTLIER -86.71 165.47 32.35 Favored Pre-proline 0 C--N 1.332 -0.158 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.192 -179.705 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_endo -56.87 -18.78 28.93 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.772 2.315 . . . . 0.0 112.972 -179.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -60.04 -54.16 49.24 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.93 0.395 . . . . 0.0 110.81 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 713' ' ' GLU . . . . . 0.431 ' HB2' ' HG ' ' A' ' 709' ' ' LEU . 2.7 mm-40 -61.28 -25.93 67.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.932 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 714' ' ' HIS . . . . . 0.497 ' CE1' ' CE2' ' A' ' 706' ' ' TYR . 0.2 OUTLIER -75.59 -54.06 7.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.254 179.529 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 22.5 ttt85 -66.22 -34.12 77.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.202 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 3.0 ttt180 -67.79 -54.28 20.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.841 0.353 . . . . 0.0 110.983 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 29.7 mt -64.62 -34.98 79.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.449 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -69.81 -53.81 16.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.405 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.48 -33.41 54.19 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.562 -179.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 720' ' ' GLU . . . . . 0.425 ' O ' ' HG2' ' A' ' 723' ' ' MET . 13.8 mt-10 -70.56 -55.73 8.18 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.036 0.446 . . . . 0.0 110.498 179.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 41.4 t -61.66 -51.58 71.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.013 -179.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 9.0 mp -56.47 -38.56 71.87 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.921 -179.188 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 723' ' ' MET . . . . . 0.425 ' HG2' ' O ' ' A' ' 720' ' ' GLU . 16.1 ptp -74.67 -41.34 60.46 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.954 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 724' ' ' GLU . . . . . 0.418 ' N ' ' HG3' ' A' ' 723' ' ' MET . 1.6 mm-40 -56.87 -30.65 64.06 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.156 -179.846 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 725' ' ' LYS . . . . . 0.425 ' HD3' ' CZ2' ' A' ' 619' ' ' TRP . 15.0 pttt -86.19 -43.52 12.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.256 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -66.38 -51.55 55.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.082 -179.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 727' ' ' ILE . . . . . . . . . . . . . 3.9 mp -87.83 11.66 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.667 -179.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 5.4 tt -52.64 -34.0 49.4 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.829 0.347 . . . . 0.0 111.142 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -83.57 -55.59 4.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.891 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 27.3 mtmm . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.27 -0.871 . . . . 0.0 110.932 -179.961 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.203 0 N-CA-C 112.549 -0.22 . . . . 0.0 112.549 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.92 -28.74 24.12 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.568 2.179 . . . . 0.0 112.295 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 3.0 mt -69.74 149.35 48.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.923 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . -83.47 -139.55 3.81 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.526 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 4.9 m 60.24 97.97 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.852 0.358 . . . . 0.0 110.97 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 1.6 mt -117.52 -176.3 2.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.855 -179.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 133.01 92.28 0.5 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.564 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.2 120.71 11.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.027 0.442 . . . . 0.0 110.591 179.651 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.44 136.33 33.49 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.864 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 619' ' ' TRP . . . . . 0.463 ' CH2' ' HB3' ' A' ' 725' ' ' LYS . 0.1 OUTLIER -64.1 -15.61 60.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.443 -179.891 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 119.93 161.72 11.65 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.385 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -68.22 -36.19 17.16 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.499 2.133 . . . . 0.0 112.264 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -67.56 -35.86 79.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.856 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 623' ' ' VAL . . . . . 0.445 HG12 ' CD2' ' A' ' 619' ' ' TRP . 40.6 t -70.44 -38.48 74.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.618 179.527 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 24.6 tp60 -68.17 -34.76 76.9 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.332 179.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.21 -50.71 69.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.33 179.511 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 8.5 tt -67.35 -33.52 75.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.711 179.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -69.09 -46.87 66.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.209 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -59.07 -49.18 78.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.073 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 7.3 mt -62.97 -35.46 71.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.109 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 5.7 ttpt -63.21 -47.85 80.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.069 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.31 -39.25 92.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.08 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 632' ' ' HIS . . . . . 0.44 ' CD2' ' HA ' ' A' ' 706' ' ' TYR . 78.5 t60 -70.73 -42.58 70.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.161 -179.876 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . 0.419 HD11 ' CD2' ' A' ' 702' ' ' TYR . 15.4 mt -58.13 -50.07 74.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.349 -179.559 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.62 -42.36 98.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.796 0.331 . . . . 0.0 110.671 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -73.59 -11.5 60.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.066 179.457 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 636' ' ' GLN . . . . . 0.4 ' CG ' ' CE1' ' A' ' 632' ' ' HIS . 15.6 mm-40 -98.62 -9.32 24.93 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.573 -179.799 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 119.06 -9.04 12.28 Favored Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.467 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 638' ' ' ILE . . . . . 0.447 HG22 ' CZ ' ' A' ' 702' ' ' TYR . 3.5 mp -100.69 104.65 16.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.748 0.309 . . . . 0.0 111.112 -179.62 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 2.4 m -76.68 113.44 14.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.89 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 1.9 mtp -129.09 31.7 4.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.97 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.55 -28.53 69.93 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.043 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -79.86 -80.13 0.13 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.041 -179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -177.54 140.14 0.43 Allowed Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.876 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -77.02 147.36 26.61 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.588 2.192 . . . . 0.0 112.481 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 5.1 tp -136.04 150.51 49.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.131 0.491 . . . . 0.0 110.965 179.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 646' ' ' ILE . . . . . 0.405 ' CG2' ' HB3' ' A' ' 651' ' ' LEU . 0.6 OUTLIER -147.85 132.19 9.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.701 179.249 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.31 41.79 62.86 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.317 -0.944 . . . . 0.0 112.345 -179.367 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 69.52 7.49 58.09 Favored Glycine 0 C--N 1.332 0.348 0 C-N-CA 121.0 -0.619 . . . . 0.0 113.779 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.7 m -132.97 163.76 28.48 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 117.358 0.579 . . . . 0.0 111.434 -179.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -79.66 144.54 33.65 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.708 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 651' ' ' LEU . . . . . 0.405 ' HB3' ' CG2' ' A' ' 646' ' ' ILE . 0.0 OUTLIER -135.11 144.93 47.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.125 0.488 . . . . 0.0 111.357 -179.661 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.9 107.26 19.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.856 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 7.2 mp -55.03 -40.21 69.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.959 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -59.19 -43.45 92.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.98 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 5.6 t -72.16 -43.03 65.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.613 179.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 656' ' ' PHE . . . . . 0.427 ' CE2' ' HG ' ' A' ' 682' ' ' LEU . 0.3 OUTLIER -60.45 -46.37 90.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.754 179.801 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -60.6 -49.5 77.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.936 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.1 -43.22 99.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.946 -179.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.55 -39.85 77.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.161 -179.87 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 660' ' ' ILE . . . . . 0.43 HG12 ' CD1' ' A' ' 678' ' ' LEU . 83.1 mt -69.01 -43.71 81.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.785 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.35 -43.35 94.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.051 -179.809 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -69.81 -13.73 62.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.355 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 1.2 ttm -94.27 21.18 7.24 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.29 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 95.44 -2.77 65.45 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.61 -0.805 . . . . 0.0 113.124 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 116.06 178.47 18.26 Favored Glycine 0 C--N 1.332 0.314 0 C-N-CA 120.539 -0.839 . . . . 0.0 112.446 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 666' ' ' MET . . . . . 0.427 ' HG2' ' CG2' ' A' ' 660' ' ' ILE . 0.0 OUTLIER -71.55 -30.85 66.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.862 0.363 . . . . 0.0 110.911 179.896 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 667' ' ' GLN . . . . . 0.401 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 19.0 pt20 -57.79 -48.74 78.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.458 -179.725 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 668' ' ' GLN . . . . . 0.409 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 8.9 mm-40 -62.37 -52.41 63.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.864 0.364 . . . . 0.0 111.334 -179.637 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 669' ' ' VAL . . . . . 0.405 HG12 ' CD1' ' A' ' 675' ' ' TRP . 73.4 t -51.4 -55.78 7.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.936 -179.646 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 670' ' ' THR . . . . . . . . . . . . . 8.0 t -76.09 -50.03 15.83 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 -178.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 671' ' ' ASP . . . . . 0.401 ' CB ' ' O ' ' A' ' 667' ' ' GLN . 5.7 t70 -61.6 -51.15 69.72 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -177.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 672' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 8.8 mp -78.59 2.7 18.42 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 -178.915 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 48.77 86.6 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.994 0.426 . . . . 0.0 110.485 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -149.15 21.75 0.96 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.077 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 675' ' ' TRP . . . . . 0.777 ' CE3' HD23 ' A' ' 678' ' ' LEU . 36.2 m95 -59.02 -27.98 65.98 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.447 0.641 . . . . 0.0 110.093 179.706 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -56.54 -42.79 79.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.542 -179.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.58 -51.62 11.28 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.784 0.326 . . . . 0.0 111.419 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.777 HD23 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.49 -39.73 70.8 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 179.693 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 679' ' ' ALA . . . . . 0.414 ' N ' ' CD2' ' A' ' 678' ' ' LEU . . . -71.94 -34.65 69.2 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.507 179.154 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -53.24 -48.5 68.16 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.433 179.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.14 -21.42 66.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.769 179.37 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 682' ' ' LEU . . . . . 0.452 ' O ' ' HB2' ' A' ' 683' ' ' ARG . 3.6 mm? -78.9 -1.41 35.0 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.496 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . 0.452 ' HB2' ' O ' ' A' ' 682' ' ' LEU . 3.5 mpt_? 68.5 71.81 0.29 Allowed 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.94 0.4 . . . . 0.0 111.489 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . 0.405 HG23 ' HD2' ' A' ' 685' ' ' PRO . 1.9 mp -123.97 136.02 26.99 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.273 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . 0.405 ' HD2' HG23 ' A' ' 684' ' ' ILE . 29.1 Cg_endo -63.25 125.33 15.52 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.418 2.079 . . . . 0.0 112.414 -179.779 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.77 -16.05 63.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.102 179.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.57 -23.95 66.97 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.216 -179.787 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 688' ' ' ALA . . . . . 0.443 ' CB ' ' HB3' ' A' ' 691' ' ' ARG . . . -77.84 115.68 17.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.859 0.361 . . . . 0.0 110.769 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -76.18 -68.24 0.6 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.376 -179.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 56.9 m-20 -57.76 -11.67 2.41 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 691' ' ' ARG . . . . . 0.443 ' HB3' ' CB ' ' A' ' 688' ' ' ALA . 4.9 ptt-85 -50.32 -32.44 17.12 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.791 0.329 . . . . 0.0 111.049 -179.843 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . 0.41 HD23 ' CG ' ' A' ' 691' ' ' ARG . 2.9 mm? -68.17 -50.39 54.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.925 -179.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.03 -37.31 69.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.039 179.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 1.3 mtpt -63.28 -37.83 88.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.243 179.576 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . 0.768 HD23 ' HB3' ' A' ' 675' ' ' TRP . 0.5 OUTLIER -68.77 -44.26 74.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.484 179.74 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . 0.435 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 31.8 tt0 -55.37 -47.7 75.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.748 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 71.1 mt-10 -77.11 -29.61 54.91 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.834 179.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . 0.405 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -66.46 -38.03 86.44 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.46 -179.901 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 699' ' ' TYR . . . . . 0.499 ' CD2' ' CZ2' ' A' ' 675' ' ' TRP . 1.0 OUTLIER -85.92 -30.53 22.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.893 0.378 . . . . 0.0 110.496 179.862 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 700' ' ' CYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 15.4 t -66.84 -30.51 70.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.644 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -99.49 -2.32 36.24 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.478 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 702' ' ' TYR . . . . . 0.447 ' CZ ' HG22 ' A' ' 638' ' ' ILE . 6.2 m-85 -117.68 -78.27 0.58 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.802 0.334 . . . . 0.0 111.214 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 75.7 mt -57.71 -43.74 85.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.464 -179.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.435 HD23 ' CE1' ' A' ' 699' ' ' TYR . 0.6 OUTLIER -55.08 -52.22 63.89 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.881 0.372 . . . . 0.0 111.008 -179.921 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 705' ' ' SER . . . . . 0.47 ' O ' HD13 ' A' ' 709' ' ' LEU . 59.7 p -54.37 -55.0 32.98 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.665 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 706' ' ' TYR . . . . . 0.44 ' HA ' ' CD2' ' A' ' 632' ' ' HIS . 9.7 t80 -46.9 -43.07 18.57 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.845 -179.571 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -94.03 0.02 55.72 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -179.48 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 22.6 t -79.19 -18.47 52.94 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -179.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 709' ' ' LEU . . . . . 0.47 HD13 ' O ' ' A' ' 705' ' ' SER . 0.0 OUTLIER -94.16 -173.92 3.23 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.831 0.348 . . . . 0.0 111.406 -179.815 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 710' ' ' SER . . . . . 0.4 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.3 OUTLIER -85.45 165.97 33.0 Favored Pre-proline 0 C--N 1.332 -0.181 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.048 -179.804 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . 0.4 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 18.0 Cg_endo -57.89 -18.93 37.12 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.625 2.217 . . . . 0.0 112.734 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -60.91 -54.27 47.06 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.913 0.387 . . . . 0.0 110.72 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 713' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -60.41 -26.06 66.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.832 179.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 714' ' ' HIS . . . . . 0.437 ' CE1' ' CZ ' ' A' ' 706' ' ' TYR . 1.3 m-70 -75.61 -53.86 7.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.114 179.255 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 6.2 mmm180 -64.65 -33.02 74.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.07 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 3.3 mtt180 -67.47 -54.28 21.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.867 0.365 . . . . 0.0 110.805 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 25.9 mt -64.12 -37.47 87.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.478 179.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -67.63 -53.92 23.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.357 179.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.3 -34.76 48.16 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.497 -179.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 720' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -67.69 -55.85 11.62 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.06 0.457 . . . . 0.0 110.279 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 44.2 t -60.78 -50.96 78.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.638 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -48.79 -46.39 41.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.907 -179.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 723' ' ' MET . . . . . . . . . . . . . 18.0 ptp -73.99 -40.77 62.72 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.098 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -50.76 -41.53 56.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.759 -179.199 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 725' ' ' LYS . . . . . 0.463 ' HB3' ' CH2' ' A' ' 619' ' ' TRP . 0.0 OUTLIER -83.23 -40.2 19.93 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.65 0.262 . . . . 0.0 111.271 -179.687 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -60.56 -52.99 62.84 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.968 0.413 . . . . 0.0 110.836 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 727' ' ' ILE . . . . . . . . . . . . . 4.2 mp -89.82 11.62 2.0 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.558 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 6.6 tt -53.87 -42.47 68.64 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.847 0.356 . . . . 0.0 111.152 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -71.98 -70.64 0.32 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.962 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.96 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.177 0 N-CA-C 112.535 -0.226 . . . . 0.0 112.535 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -52.33 -35.22 63.67 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.566 2.177 . . . . 0.0 112.341 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.88 175.86 6.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.907 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . -155.23 96.18 0.16 Allowed Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.497 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.37 33.15 1.49 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.818 0.342 . . . . 0.0 110.881 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 26.6 mt -68.97 156.79 37.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.924 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . 0.409 ' O ' ' HD2' ' A' ' 617' ' ' ARG . . . -110.94 -61.27 0.48 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.529 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . 0.436 ' HD2' ' HA ' ' A' ' 617' ' ' ARG . 24.5 mmm180 -156.85 124.56 5.44 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.935 0.398 . . . . 0.0 110.888 179.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.05 127.48 14.98 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.876 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 619' ' ' TRP . . . . . 0.419 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.1 OUTLIER -64.66 -14.85 60.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.439 -179.948 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 118.53 161.32 11.78 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.373 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -67.47 -39.81 11.76 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.497 2.131 . . . . 0.0 112.332 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -65.08 -35.97 82.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.941 -179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 623' ' ' VAL . . . . . 0.419 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 42.1 t -67.81 -43.62 86.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.751 179.686 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 40.9 tp60 -59.49 -42.68 92.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.526 179.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -58.66 -50.75 72.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.429 179.596 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 6.6 tt -65.7 -28.31 68.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.79 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -71.4 -52.56 17.89 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.587 -179.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 29.5 p -60.84 -38.63 86.18 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.396 -179.533 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 51.3 mt -66.72 -45.54 87.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.329 -179.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 43.8 pttt -66.24 -33.89 76.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.722 0.296 . . . . 0.0 110.987 -179.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 2.0 tttm -67.35 -46.8 72.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.014 0.435 . . . . 0.0 110.79 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 632' ' ' HIS . . . . . 0.449 ' CE1' ' CD1' ' A' ' 709' ' ' LEU . 86.6 t60 -67.28 -39.61 86.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.734 179.77 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . . . . . . . . . 21.8 mt -57.82 -48.99 78.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.047 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 634' ' ' ARG . . . . . 0.415 ' HG3' ' N ' ' A' ' 635' ' ' SER . 0.1 OUTLIER -63.16 -40.6 98.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.831 179.974 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 635' ' ' SER . . . . . 0.415 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 1.6 m -73.68 -19.93 60.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.219 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -90.58 -7.45 52.79 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.677 -179.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 117.92 -13.12 12.98 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.478 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 638' ' ' ILE . . . . . 0.447 HG22 ' CZ ' ' A' ' 702' ' ' TYR . 2.8 mp -94.38 104.59 15.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 120.608 0.242 . . . . 0.0 111.219 -179.716 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -77.56 121.34 23.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.837 0.351 . . . . 0.0 111.007 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 1.9 ttp -133.02 30.19 4.0 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.882 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -65.56 -33.99 77.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.872 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -69.59 -77.39 0.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.846 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 1.4 pp -179.98 136.68 0.28 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.873 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.81 121.01 7.0 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.499 2.132 . . . . 0.0 112.168 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 5.0 tp -119.88 149.52 41.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.221 0.534 . . . . 0.0 111.287 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 646' ' ' ILE . . . . . 0.409 ' CG2' ' HB3' ' A' ' 651' ' ' LEU . 1.2 tt -144.83 130.15 14.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.45 178.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . 0.408 ' O ' ' NH1' ' A' ' 691' ' ' ARG . . . 51.91 47.0 54.82 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.269 -0.967 . . . . 0.0 112.086 -179.157 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 64.79 7.67 30.2 Favored Glycine 0 CA--C 1.521 0.421 0 C-N-CA 121.034 -0.603 . . . . 0.0 113.899 179.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 98.7 m -129.73 161.7 30.08 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 117.592 0.696 . . . . 0.0 111.516 -179.21 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -81.19 142.55 33.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.638 179.659 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 651' ' ' LEU . . . . . 0.409 ' HB3' ' CG2' ' A' ' 646' ' ' ILE . 0.0 OUTLIER -134.9 144.72 47.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.041 0.448 . . . . 0.0 111.309 -179.737 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -94.16 109.18 20.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.782 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 6.3 mp -56.67 -35.41 68.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.867 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -65.09 -46.81 79.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.958 179.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 46.9 t -70.58 -32.66 70.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.562 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 656' ' ' PHE . . . . . 0.473 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.2 OUTLIER -70.55 -46.07 64.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.81 179.881 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -60.14 -49.98 75.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.933 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -58.23 -43.99 88.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.963 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.49 -48.01 80.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.253 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 660' ' ' ILE . . . . . 0.523 ' CG2' ' HA ' ' A' ' 666' ' ' MET . 23.3 mt -56.85 -45.73 83.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.916 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -64.68 -47.19 79.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.029 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -62.38 -16.75 56.51 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.441 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -94.25 31.86 1.63 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.67 0.272 . . . . 0.0 111.295 -179.826 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 76.15 42.37 24.24 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.824 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 78.21 172.76 40.55 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.707 179.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 666' ' ' MET . . . . . 0.523 ' HA ' ' CG2' ' A' ' 660' ' ' ILE . 0.0 OUTLIER -73.13 -33.66 65.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.769 0.319 . . . . 0.0 111.322 179.963 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 16.0 pt20 -53.05 -43.76 66.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.322 -179.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 668' ' ' GLN . . . . . 0.446 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -64.66 -52.48 57.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.972 0.415 . . . . 0.0 110.707 -179.968 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 669' ' ' VAL . . . . . 0.417 ' HB ' ' HE1' ' A' ' 666' ' ' MET . 90.6 t -49.28 -55.52 4.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.567 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 670' ' ' THR . . . . . 0.439 ' HB ' ' CE ' ' A' ' 666' ' ' MET . 8.8 t -76.19 -51.47 12.05 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -178.467 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -63.72 -51.3 65.59 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -177.658 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 672' ' ' LEU . . . . . 0.446 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 9.3 mp -77.3 3.34 13.23 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -179.039 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 49.02 86.35 0.03 OUTLIER 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.966 0.412 . . . . 0.0 110.509 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 21.0 mttt -146.2 21.91 1.37 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.261 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 675' ' ' TRP . . . . . 0.781 ' CE3' HD21 ' A' ' 678' ' ' LEU . 42.5 m95 -60.91 -28.57 69.02 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 121.401 0.619 . . . . 0.0 110.167 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -55.76 -43.84 77.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.534 -179.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 2.7 ttmm -77.09 -51.53 10.88 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 120.769 0.318 . . . . 0.0 111.4 -179.49 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.781 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -54.92 -41.25 70.75 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 179.65 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 679' ' ' ALA . . . . . 0.409 ' N ' ' CD2' ' A' ' 678' ' ' LEU . . . -71.78 -34.51 69.48 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.766 179.283 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -53.17 -47.67 68.61 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.394 179.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 20.1 mtm -64.67 -21.57 66.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.764 179.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 682' ' ' LEU . . . . . 0.499 ' O ' ' HB2' ' A' ' 683' ' ' ARG . 3.2 mm? -80.11 -2.08 42.94 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.464 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . 0.499 ' HB2' ' O ' ' A' ' 682' ' ' LEU . 0.2 OUTLIER 72.34 71.76 0.15 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.925 0.393 . . . . 0.0 111.7 179.81 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . 0.441 HG23 ' HD2' ' A' ' 685' ' ' PRO . 2.1 mp -129.22 139.95 37.2 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.062 179.406 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . 0.441 ' HD2' HG23 ' A' ' 684' ' ' ILE . 41.0 Cg_endo -66.83 124.81 12.79 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.303 2.002 . . . . 0.0 112.381 -179.745 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -19.18 63.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.19 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.34 -18.81 65.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.384 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 688' ' ' ALA . . . . . 0.43 ' CB ' ' NE ' ' A' ' 691' ' ' ARG . . . -84.47 107.08 16.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.863 0.363 . . . . 0.0 111.056 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -70.82 -67.77 0.48 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.06 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 45.1 m-20 -48.96 -20.93 0.57 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.972 -179.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 691' ' ' ARG . . . . . 0.43 ' NE ' ' CB ' ' A' ' 688' ' ' ALA . 1.4 ttm180 -46.37 -40.35 11.83 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.803 0.335 . . . . 0.0 111.297 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -63.15 -46.46 87.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.183 -179.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.15 -38.67 69.13 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.774 0.321 . . . . 0.0 111.233 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 16.4 mmtt -63.54 -42.19 98.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.989 0.424 . . . . 0.0 110.339 179.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . 0.747 HD23 ' HB3' ' A' ' 675' ' ' TRP . 0.2 OUTLIER -66.84 -40.67 88.04 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.404 179.646 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . 0.425 ' O ' ' CD2' ' A' ' 699' ' ' TYR . 8.9 mt-30 -57.74 -44.98 86.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.788 179.733 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -77.31 -29.81 53.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.203 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . 0.4 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.28 -38.36 84.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.653 -179.704 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 699' ' ' TYR . . . . . 0.523 ' CZ ' ' HE2' ' A' ' 666' ' ' MET . 1.8 p90 -83.65 -37.23 23.1 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.864 0.364 . . . . 0.0 110.484 179.875 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 700' ' ' CYS . . . . . 0.435 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 6.8 t -62.18 -30.64 71.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.553 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -95.83 -3.49 45.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.32 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 702' ' ' TYR . . . . . 0.447 ' CZ ' HG22 ' A' ' 638' ' ' ILE . 10.1 m-85 -118.46 -78.53 0.58 Allowed 'General case' 0 CA--C 1.529 0.14 0 CA-C-O 120.849 0.356 . . . . 0.0 111.59 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 23.2 mt -60.22 -43.85 95.68 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.966 -179.069 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.454 HD22 ' CE1' ' A' ' 699' ' ' TYR . 0.4 OUTLIER -47.9 -56.65 7.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.82 0.343 . . . . 0.0 111.647 -179.442 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 42.3 p -54.4 -48.57 71.43 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.405 -179.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 706' ' ' TYR . . . . . . . . . . . . . 57.3 t80 -65.51 -29.21 69.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.529 -179.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -96.95 0.64 49.24 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -179.438 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 39.8 t -115.54 -12.77 11.6 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 111.771 0.285 . . . . 0.0 111.771 -179.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 709' ' ' LEU . . . . . 0.449 ' CD1' ' CE1' ' A' ' 632' ' ' HIS . 0.3 OUTLIER -79.71 179.46 7.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.743 0.306 . . . . 0.0 111.04 -179.969 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -75.04 164.45 61.28 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.143 -179.85 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -68.87 -25.94 32.41 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.645 2.23 . . . . 0.0 112.203 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -50.55 -49.83 55.04 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.748 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 713' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -59.89 -27.24 66.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.024 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 714' ' ' HIS . . . . . 0.413 ' CD2' HD21 ' A' ' 709' ' ' LEU . 12.8 m170 -76.14 -54.03 7.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.501 179.484 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.16 -44.25 97.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.437 -179.614 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 20.8 mtp85 -66.19 -54.18 28.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.223 -179.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 53.1 mt -62.64 -39.54 94.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.674 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -67.33 -54.03 24.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.33 179.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -50.53 -34.7 26.39 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.337 -179.791 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 720' ' ' GLU . . . . . 0.401 ' O ' ' HG2' ' A' ' 723' ' ' MET . 0.5 OUTLIER -69.39 -55.43 10.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.005 0.431 . . . . 0.0 110.561 179.626 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 16.8 t -62.03 -54.94 27.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.156 -179.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 1.2 mp -50.51 -44.18 56.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.009 -179.266 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 723' ' ' MET . . . . . 0.401 ' HG2' ' O ' ' A' ' 720' ' ' GLU . 16.9 ptp -71.44 -40.31 70.47 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.496 -0.481 . . . . 0.0 110.024 179.719 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -57.49 -31.58 66.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.381 -179.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 725' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.14 -43.14 13.28 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.404 -179.67 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -66.52 -48.93 68.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.834 0.349 . . . . 0.0 111.193 -179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 727' ' ' ILE . . . . . 0.402 ' O ' ' CG2' ' A' ' 727' ' ' ILE . 3.9 mp -88.96 11.67 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.534 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 5.6 tt -57.38 -36.41 71.21 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.789 0.328 . . . . 0.0 111.028 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -64.57 -68.65 0.34 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.934 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.895 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.231 0 N-CA-C 112.428 -0.269 . . . . 0.0 112.428 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.23 -37.36 5.98 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.572 2.181 . . . . 0.0 112.303 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -80.9 -178.95 7.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.909 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . -159.86 -93.74 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.484 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 24.4 t -171.48 35.76 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.827 0.346 . . . . 0.0 110.922 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 16.4 mt -83.21 158.81 22.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.908 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -141.54 56.02 0.6 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.462 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 3.5 mtp180 -99.41 -1.96 37.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.198 0.523 . . . . 0.0 111.564 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.49 156.09 44.02 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.986 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 619' ' ' TRP . . . . . 0.453 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.0 OUTLIER -83.28 -17.85 41.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.258 179.913 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 123.44 163.25 11.71 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.443 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -66.75 -39.11 15.93 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.542 2.162 . . . . 0.0 112.118 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -63.15 -39.25 94.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.888 179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 623' ' ' VAL . . . . . 0.453 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 38.8 t -73.29 -35.32 46.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.781 179.701 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? -60.2 -42.43 95.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.689 179.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 4.8 tpp180 -69.32 -48.54 61.17 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.72 179.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 8.1 tt -61.45 -30.74 70.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.828 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -72.02 -50.63 26.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.201 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -57.2 -46.94 82.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.999 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 12.6 mt -64.47 -39.2 84.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.91 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 10.6 ttpt -60.77 -49.73 76.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.738 179.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 9.5 tttm -59.5 -38.17 80.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.75 179.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 632' ' ' HIS . . . . . 0.449 ' CE1' ' CD1' ' A' ' 709' ' ' LEU . 81.8 t60 -70.08 -44.25 69.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.83 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 633' ' ' LEU . . . . . 0.455 ' CD2' ' CD2' ' A' ' 702' ' ' TYR . 10.6 mt -55.89 -50.2 71.3 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.369 -179.552 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.92 -41.8 97.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.765 0.317 . . . . 0.0 110.75 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 6.7 t -73.5 -11.5 60.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.958 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 35.5 mm-40 -99.04 -10.59 22.41 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.551 -179.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 117.12 -0.83 19.31 Favored Glycine 0 C--N 1.332 0.34 0 C-N-CA 120.581 -0.819 . . . . 0.0 112.623 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 638' ' ' ILE . . . . . 0.416 HG21 ' CE2' ' A' ' 702' ' ' TYR . 13.8 mt -108.44 109.94 30.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 120.712 0.292 . . . . 0.0 111.327 -179.47 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 5.1 m -83.81 115.06 22.05 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.861 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 1.6 mtp -125.38 30.73 5.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.964 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -64.02 -30.76 71.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.956 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -74.51 -80.09 0.08 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.957 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 8.7 tp -179.08 132.09 0.27 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.845 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_endo -74.49 137.86 23.55 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.481 2.121 . . . . 0.0 112.279 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 645' ' ' LEU . . . . . . . . . . . . . 4.8 tp -129.19 151.6 49.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.187 0.518 . . . . 0.0 111.236 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 646' ' ' ILE . . . . . 0.408 ' CG2' ' HB3' ' A' ' 651' ' ' LEU . 1.3 tt -149.64 133.51 8.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.873 179.086 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 54.64 38.35 63.46 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.342 -0.933 . . . . 0.0 112.221 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.05 7.92 63.59 Favored Glycine 0 C--N 1.333 0.377 0 C-N-CA 120.924 -0.655 . . . . 0.0 113.595 179.353 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 2.1 m -133.73 163.89 28.45 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 117.315 0.557 . . . . 0.0 111.424 -179.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 650' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -78.28 145.52 35.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.669 179.679 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 651' ' ' LEU . . . . . 0.408 ' HB3' ' CG2' ' A' ' 646' ' ' ILE . 0.0 OUTLIER -134.79 145.0 47.97 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.085 0.469 . . . . 0.0 111.466 -179.615 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -96.85 109.25 21.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.725 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 8.2 mp -53.85 -35.29 61.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.949 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -65.02 -43.57 92.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.007 179.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 49.6 t -72.87 -33.6 66.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.655 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 656' ' ' PHE . . . . . 0.432 ' CE2' ' HG ' ' A' ' 682' ' ' LEU . 0.3 OUTLIER -71.47 -47.92 52.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.805 179.891 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -59.45 -49.16 78.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.893 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 22.2 tpp180 -59.66 -41.93 91.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.868 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.5 -49.18 78.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.103 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 660' ' ' ILE . . . . . 0.5 ' CG2' ' HA ' ' A' ' 666' ' ' MET . 27.9 mt -56.79 -45.66 83.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.791 0.329 . . . . 0.0 110.819 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -62.73 -42.31 99.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.884 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -72.11 -11.02 60.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.307 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -96.49 32.3 2.05 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.806 0.336 . . . . 0.0 111.047 -179.876 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 75.06 36.55 45.93 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.602 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 82.49 171.23 46.46 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.53 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 666' ' ' MET . . . . . 0.5 ' HA ' ' CG2' ' A' ' 660' ' ' ILE . 0.0 OUTLIER -72.49 -32.82 66.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.839 0.352 . . . . 0.0 111.035 179.962 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 27.5 tt0 -54.13 -48.88 70.32 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.193 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 668' ' ' GLN . . . . . 0.415 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -63.5 -50.63 68.88 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.827 0.346 . . . . 0.0 111.321 -179.632 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 669' ' ' VAL . . . . . . . . . . . . . 57.2 t -49.04 -52.66 9.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.917 0.389 . . . . 0.0 111.159 179.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 670' ' ' THR . . . . . . . . . . . . . 7.6 t -76.3 -53.92 7.51 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -178.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 671' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -60.2 -51.41 69.68 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 -177.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 672' ' ' LEU . . . . . 0.415 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 6.9 mp -75.96 1.66 14.69 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -178.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 49.54 82.17 0.05 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.999 0.428 . . . . 0.0 110.297 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 11.1 ttpt -142.19 23.4 2.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.272 -179.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 675' ' ' TRP . . . . . 0.786 ' CE3' HD21 ' A' ' 678' ' ' LEU . 38.5 m95 -62.49 -28.54 69.9 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 121.361 0.6 . . . . 0.0 110.21 179.809 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -56.69 -44.41 81.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.49 -179.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.11 -51.51 12.07 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 120.814 0.34 . . . . 0.0 111.267 -179.602 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 678' ' ' LEU . . . . . 0.786 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.21 -40.44 70.79 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 179.523 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 679' ' ' ALA . . . . . 0.417 ' N ' ' CD2' ' A' ' 678' ' ' LEU . . . -71.64 -33.9 69.32 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.59 179.188 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -53.54 -48.73 68.81 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.484 179.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 2.4 mtm -64.12 -20.02 65.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.968 179.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 682' ' ' LEU . . . . . 0.432 ' HG ' ' CE2' ' A' ' 656' ' ' PHE . 3.7 mm? -81.85 -0.98 45.98 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.513 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 683' ' ' ARG . . . . . 0.427 ' HB2' ' O ' ' A' ' 682' ' ' LEU . 5.1 mmm180 66.84 71.88 0.37 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.895 0.379 . . . . 0.0 111.603 179.729 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 684' ' ' ILE . . . . . 0.467 HG21 ' HD2' ' A' ' 685' ' ' PRO . 2.1 mp -123.24 139.06 30.97 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.368 179.52 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 685' ' ' PRO . . . . . 0.467 ' HD2' HG21 ' A' ' 684' ' ' ILE . 33.0 Cg_endo -64.79 123.61 11.92 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.422 2.082 . . . . 0.0 112.454 -179.701 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 4.1 mmmt -69.92 -20.47 63.35 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.212 179.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 19.1 p -65.52 -23.86 66.98 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.555 -179.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -69.14 110.77 4.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.756 0.312 . . . . 0.0 111.323 -179.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -83.38 4.68 26.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.527 179.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -119.33 -17.79 8.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.904 0.383 . . . . 0.0 110.674 179.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 691' ' ' ARG . . . . . 0.467 ' O ' ' HB3' ' A' ' 695' ' ' LEU . 8.3 ptt85 -49.81 -36.47 26.61 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.542 -179.715 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -68.77 -52.64 28.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.623 -179.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.99 -39.65 69.1 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.838 0.352 . . . . 0.0 111.288 -179.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -61.86 -40.0 93.83 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.094 0.473 . . . . 0.0 110.15 179.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 695' ' ' LEU . . . . . 0.76 HD23 ' HB3' ' A' ' 675' ' ' TRP . 2.7 tp -65.57 -45.34 83.67 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.53 179.57 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 696' ' ' GLN . . . . . 0.449 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 9.8 mt-30 -55.43 -50.85 68.74 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.05 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -74.14 -29.67 61.92 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.01 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 698' ' ' ALA . . . . . 0.416 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.89 -39.29 83.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.602 -179.765 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 699' ' ' TYR . . . . . 0.517 ' CD2' ' CZ2' ' A' ' 675' ' ' TRP . 0.7 OUTLIER -86.0 -31.25 22.14 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.032 0.444 . . . . 0.0 110.485 179.84 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 700' ' ' CYS . . . . . 0.421 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 43.8 t -66.92 -30.52 70.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.852 179.89 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.14 -1.16 37.39 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.567 -179.719 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 702' ' ' TYR . . . . . 0.455 ' CD2' ' CD2' ' A' ' 633' ' ' LEU . 5.8 m-85 -119.06 -79.08 0.59 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.821 0.343 . . . . 0.0 111.326 -179.8 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 3.8 tp -56.44 -43.06 79.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.571 -179.395 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 704' ' ' LEU . . . . . 0.453 HD23 ' CE1' ' A' ' 699' ' ' TYR . 1.1 mm? -53.01 -37.17 61.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.893 0.378 . . . . 0.0 111.164 -179.771 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 3.9 m -65.63 -54.94 20.68 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.796 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 706' ' ' TYR . . . . . 0.492 ' CZ ' ' CE1' ' A' ' 714' ' ' HIS . 21.0 t80 -60.35 -29.19 68.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.738 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 4.8 p30 -96.91 -7.21 33.88 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -179.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 708' ' ' SER . . . . . 0.402 ' CB ' ' O ' ' A' ' 704' ' ' LEU . 41.8 m -102.89 -22.55 13.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.708 0.29 . . . . 0.0 111.363 -179.845 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 709' ' ' LEU . . . . . 0.449 ' CD1' ' CE1' ' A' ' 632' ' ' HIS . 0.2 OUTLIER -71.43 170.97 12.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.772 0.32 . . . . 0.0 111.005 -179.941 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.63 166.75 41.38 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.168 -179.687 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 711' ' ' PRO . . . . . 0.403 ' O ' ' HB2' ' A' ' 714' ' ' HIS . 38.0 Cg_endo -66.53 -32.03 40.25 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.57 2.18 . . . . 0.0 112.045 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -48.86 -48.69 41.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.578 179.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 713' ' ' GLU . . . . . 0.42 ' HB2' ' CD1' ' A' ' 709' ' ' LEU . 6.2 mm-40 -59.71 -26.2 65.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.111 179.633 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 714' ' ' HIS . . . . . 0.492 ' CE1' ' CZ ' ' A' ' 706' ' ' TYR . 1.6 m-70 -75.87 -54.05 7.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.387 179.665 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.77 -42.43 99.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.282 -179.657 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -66.37 -54.25 26.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.821 0.343 . . . . 0.0 111.16 -179.598 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 717' ' ' LEU . . . . . . . . . . . . . 73.4 mt -63.64 -39.91 95.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.723 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -67.52 -54.32 21.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.302 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -50.72 -34.94 28.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.358 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 720' ' ' GLU . . . . . 0.409 ' O ' ' HG2' ' A' ' 723' ' ' MET . 2.9 mm-40 -70.51 -55.42 8.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.996 0.427 . . . . 0.0 110.723 179.842 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 38.6 t -62.48 -54.87 28.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.112 -179.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 3.6 mp -53.57 -40.04 65.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.872 -179.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 723' ' ' MET . . . . . 0.409 ' HG2' ' O ' ' A' ' 720' ' ' GLU . 9.5 ptp -74.59 -41.21 60.88 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 120.407 -0.517 . . . . 0.0 109.949 179.475 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -55.61 -42.74 75.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.835 -179.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 725' ' ' LYS . . . . . 0.421 ' HB3' ' CH2' ' A' ' 619' ' ' TRP . 0.0 OUTLIER -79.12 -36.66 40.27 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.661 -179.29 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -69.39 -53.27 20.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.837 0.351 . . . . 0.0 111.044 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 727' ' ' ILE . . . . . . . . . . . . . 3.7 mp -88.51 11.65 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.621 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 1.9 tt -53.98 -47.4 71.42 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.798 0.332 . . . . 0.0 111.121 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -73.21 -53.45 10.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.949 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 24.3 mtmt . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.896 179.968 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 619' ' ' TRP . . . . . 0.491 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.462 0.141 0 CA-C-O 120.56 0.219 . . . . 0.0 111.366 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 122.11 163.76 12.0 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.507 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -67.61 -40.76 9.59 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.597 2.198 . . . . 0.0 112.26 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 -62.27 -36.42 82.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.854 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 623' ' ' VAL . . . . . 0.481 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 43.0 t -75.77 -39.63 38.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.817 179.693 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 624' ' ' GLN . . . . . 0.523 ' CG ' HD11 ' A' ' 722' ' ' LEU . 3.8 tm0? -64.76 -40.53 95.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.669 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.24 -49.97 65.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.736 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 626' ' ' LEU . . . . . 0.619 HD23 ' O ' ' A' ' 626' ' ' LEU . 7.1 tt -63.48 -32.13 73.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.914 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -71.49 -50.16 34.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.317 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.21 -46.46 82.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.157 -179.727 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 30.3 mt -64.24 -40.85 90.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.056 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 7.4 ttpt -62.82 -47.24 84.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.999 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 1.3 tttm -59.1 -40.47 85.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.258 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 632' ' ' HIS . . . . . 0.692 ' NE2' HD21 ' A' ' 709' ' ' LEU . 31.9 t-80 -72.78 -42.1 64.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.085 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.67 HD13 ' SD ' ' A' ' 640' ' ' MET . 20.2 mt -55.96 -49.85 72.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.355 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 634' ' ' ARG . . . . . 0.41 ' HA ' ' O ' ' A' ' 638' ' ' ILE . 1.0 OUTLIER -68.34 -39.48 81.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.847 179.988 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 1.3 m -73.68 -11.58 60.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.353 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 2.8 tp60 -100.32 -4.62 28.83 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 111.733 0.271 . . . . 0.0 111.733 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 113.23 -0.44 25.27 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.493 -0.86 . . . . 0.0 112.593 179.453 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 638' ' ' ILE . . . . . 0.41 ' O ' ' HA ' ' A' ' 634' ' ' ARG . 13.7 mt -108.63 104.68 17.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-O 120.666 0.27 . . . . 0.0 111.202 -179.421 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 1.6 m -77.42 116.8 18.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.876 0.369 . . . . 0.0 110.94 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 640' ' ' MET . . . . . 0.67 ' SD ' HD13 ' A' ' 633' ' ' LEU . 2.1 ttp -130.49 30.7 4.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.838 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -66.81 -39.31 87.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.01 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 642' ' ' GLU . . . . . 0.532 ' O ' HD12 ' A' ' 643' ' ' LEU . 6.6 mm-40 -63.57 -79.9 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.935 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 643' ' ' LEU . . . . . 0.532 HD12 ' O ' ' A' ' 642' ' ' GLU . 0.1 OUTLIER -178.37 132.34 0.3 Allowed Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.803 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 644' ' ' PRO . . . . . 0.548 ' HB2' HD11 ' A' ' 651' ' ' LEU . 74.4 Cg_endo -75.23 142.76 27.57 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.488 2.125 . . . . 0.0 112.266 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 645' ' ' LEU . . . . . 0.658 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.8 tp -133.84 151.93 51.7 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.211 0.529 . . . . 0.0 111.211 179.795 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 646' ' ' ILE . . . . . 0.742 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.1 tt -149.8 133.89 8.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.905 179.107 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.41 38.55 57.8 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.363 -0.922 . . . . 0.0 112.097 -179.335 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.2 7.88 64.17 Favored Glycine 0 CA--C 1.52 0.385 0 C-N-CA 120.94 -0.648 . . . . 0.0 113.584 179.535 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -132.67 162.55 31.1 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 117.311 0.556 . . . . 0.0 111.4 -179.307 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 650' ' ' GLU . . . . . 0.658 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.7 OUTLIER -77.78 145.21 36.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.793 179.888 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 651' ' ' LEU . . . . . 0.638 HD23 ' HD2' ' A' ' 656' ' ' PHE . 0.0 OUTLIER -135.22 145.37 47.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.373 -179.695 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -99.89 113.33 25.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.944 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -52.37 -39.44 60.79 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.127 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -63.69 -43.88 95.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.03 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 10.6 t -70.07 -38.31 75.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.746 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 656' ' ' PHE . . . . . 0.638 ' HD2' HD23 ' A' ' 651' ' ' LEU . 0.1 OUTLIER -68.7 -46.3 69.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.794 179.943 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 43.9 t80 -57.46 -48.79 78.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.893 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -60.66 -40.73 93.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.955 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 659' ' ' LEU . . . . . 0.453 HD11 ' CE ' ' A' ' 681' ' ' MET . 0.2 OUTLIER -57.95 -51.67 68.69 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.163 -179.752 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 660' ' ' ILE . . . . . 0.624 HG23 HG21 ' A' ' 669' ' ' VAL . 33.3 mt -56.75 -46.14 83.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 120.821 0.343 . . . . 0.0 111.127 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 23.6 t30 -61.43 -39.82 92.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.078 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -68.26 -13.85 62.56 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.51 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.46 36.61 1.24 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.797 0.332 . . . . 0.0 111.099 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 67.92 25.88 74.12 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.644 -0.788 . . . . 0.0 112.424 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 96.4 170.07 34.57 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.541 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 666' ' ' MET . . . . . 0.521 ' O ' HG22 ' A' ' 670' ' ' THR . 10.0 tpt -65.6 -37.74 87.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.727 0.298 . . . . 0.0 111.217 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 667' ' ' GLN . . . . . 0.432 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 4.9 pt20 -50.62 -43.69 56.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.449 -179.665 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 668' ' ' GLN . . . . . 0.419 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -66.96 -52.59 40.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.815 0.341 . . . . 0.0 110.973 -179.9 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 669' ' ' VAL . . . . . 0.624 HG21 HG23 ' A' ' 660' ' ' ILE . 55.4 t -49.19 -54.65 5.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.461 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 670' ' ' THR . . . . . 0.521 HG22 ' O ' ' A' ' 666' ' ' MET . 14.0 t -76.15 -52.51 9.94 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -178.682 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 671' ' ' ASP . . . . . 0.499 ' N ' HG23 ' A' ' 670' ' ' THR . 19.0 t70 -59.45 -51.15 71.12 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -177.879 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 672' ' ' LEU . . . . . 0.419 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 4.5 mm? -76.42 0.87 18.08 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 3.1 mtpm? 49.71 81.77 0.06 Allowed 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.017 0.437 . . . . 0.0 110.363 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 3.9 mttm -144.48 20.18 1.7 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.193 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 675' ' ' TRP . . . . . 1.147 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 26.0 m95 -55.75 -29.85 60.25 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.324 0.583 . . . . 0.0 110.236 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 -55.88 -41.7 74.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.843 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.69 -51.76 10.07 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.173 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 1.057 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -58.09 -40.51 81.32 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 179.691 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 679' ' ' ALA . . . . . 0.801 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -70.27 -36.13 74.22 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.554 179.184 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -53.36 -48.42 68.57 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.403 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 681' ' ' MET . . . . . 0.453 ' CE ' HD11 ' A' ' 659' ' ' LEU . 31.6 mtm -64.08 -23.07 67.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.844 179.492 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 682' ' ' LEU . . . . . 0.471 HD23 ' O ' ' A' ' 678' ' ' LEU . 3.4 mm? -78.21 -3.12 41.07 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.472 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 683' ' ' ARG . . . . . 0.695 ' C ' HD12 ' A' ' 684' ' ' ILE . 3.4 mtp85 70.4 71.74 0.21 Allowed 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.915 0.388 . . . . 0.0 111.592 179.6 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 684' ' ' ILE . . . . . 0.695 HD12 ' C ' ' A' ' 683' ' ' ARG . 2.2 mp -123.66 141.37 36.39 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.223 179.459 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 685' ' ' PRO . . . . . 0.651 ' HD2' HG23 ' A' ' 684' ' ' ILE . 44.2 Cg_endo -69.07 120.94 7.77 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.543 2.162 . . . . 0.0 112.752 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.01 -21.59 63.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.103 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.46 -22.33 66.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.601 -179.414 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 688' ' ' ALA . . . . . 0.74 ' HB3' ' HG2' ' A' ' 691' ' ' ARG . . . -72.24 116.24 12.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.929 0.395 . . . . 0.0 111.218 -179.814 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -83.44 4.9 25.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.396 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -121.88 -15.18 7.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.087 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 691' ' ' ARG . . . . . 0.809 ' HG3' HD22 ' A' ' 692' ' ' LEU . 0.5 OUTLIER -55.84 -32.8 63.92 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.088 -179.639 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 692' ' ' LEU . . . . . 0.809 HD22 ' HG3' ' A' ' 691' ' ' ARG . 3.3 mm? -70.58 -54.12 13.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.462 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.23 -37.66 72.0 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.417 -179.544 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 2.8 mmmt -64.28 -38.63 91.73 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.089 0.471 . . . . 0.0 109.896 179.375 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 1.147 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 4.3 tp -64.9 -47.12 78.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.812 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.404 ' HA ' ' CD2' ' A' ' 699' ' ' TYR . 24.8 mt-30 -55.21 -49.01 73.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.206 -179.669 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -76.02 -29.65 58.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.206 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 698' ' ' ALA . . . . . 0.406 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.26 -36.83 82.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.879 -179.585 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 699' ' ' TYR . . . . . 0.504 ' CE1' ' HE2' ' A' ' 666' ' ' MET . 1.5 p90 -85.63 -36.31 20.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.973 0.416 . . . . 0.0 110.495 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 700' ' ' CYS . . . . . . . . . . . . . 5.6 t -62.95 -30.59 71.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.538 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -96.77 -5.32 38.8 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.453 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 702' ' ' TYR . . . . . 0.411 ' CD2' HD21 ' A' ' 633' ' ' LEU . 6.1 m-85 -119.11 -78.21 0.58 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.851 0.358 . . . . 0.0 111.254 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 703' ' ' LEU . . . . . 0.474 ' HA ' HD13 ' A' ' 703' ' ' LEU . 3.9 mm? -55.34 -42.62 74.07 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.47 -179.506 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.456 HD23 ' CE1' ' A' ' 699' ' ' TYR . 1.1 mm? -61.64 -56.03 24.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.144 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.65 -55.27 31.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.961 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 706' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -59.59 -51.11 71.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.017 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -58.8 -20.57 51.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.282 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 1.4 m -84.29 -16.3 43.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.974 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 709' ' ' LEU . . . . . 0.692 HD21 ' NE2' ' A' ' 632' ' ' HIS . 62.3 mt -50.63 141.37 12.77 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.501 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 710' ' ' SER . . . . . 0.454 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.6 OUTLIER -75.92 168.25 29.5 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.597 179.742 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 711' ' ' PRO . . . . . 0.454 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 10.7 Cg_endo -54.13 -25.88 39.42 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.53 2.154 . . . . 0.0 112.376 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -69.98 -53.97 15.37 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.019 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 713' ' ' GLU . . . . . 0.519 ' HB2' ' HB3' ' A' ' 709' ' ' LEU . 62.1 mm-40 -59.73 -26.22 65.46 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.907 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 8.1 m-70 -75.89 -54.16 7.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.355 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.28 -41.77 99.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.344 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 2.8 mmm-85 -65.49 -54.2 31.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.858 0.361 . . . . 0.0 111.29 -179.629 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 717' ' ' LEU . . . . . 0.482 HD13 ' HB2' ' A' ' 632' ' ' HIS . 55.0 mt -65.44 -40.63 93.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.015 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 718' ' ' GLU . . . . . 0.74 ' HG2' HD22 ' A' ' 722' ' ' LEU . 30.8 tt0 -67.99 -54.32 19.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.639 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.98 -34.55 56.52 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.465 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 720' ' ' GLU . . . . . 0.43 ' O ' ' HG2' ' A' ' 723' ' ' MET . 0.4 OUTLIER -67.51 -55.9 11.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.021 0.438 . . . . 0.0 110.494 179.832 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 721' ' ' VAL . . . . . 0.491 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 33.3 t -64.06 -52.92 50.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.156 -179.637 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 722' ' ' LEU . . . . . 0.74 HD22 ' HG2' ' A' ' 718' ' ' GLU . 5.1 mp -49.03 -44.8 41.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.918 -179.397 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 723' ' ' MET . . . . . 0.527 ' HB2' HD13 ' A' ' 727' ' ' ILE . 18.8 ptp -72.19 -40.04 68.19 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.239 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 724' ' ' GLU . . . . . 0.409 ' N ' ' HG3' ' A' ' 723' ' ' MET . 5.5 mm-40 -52.64 -34.84 53.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.436 -179.646 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 725' ' ' LYS . . . . . 0.455 ' HD3' ' CE2' ' A' ' 619' ' ' TRP . 4.4 pttm -86.09 -40.29 15.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.455 -179.645 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -66.14 -52.59 46.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.383 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 727' ' ' ILE . . . . . 0.662 ' O ' HG22 ' A' ' 727' ' ' ILE . 4.6 mp -87.09 11.55 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.679 -179.746 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 728' ' ' LEU . . . . . 0.43 ' O ' HD23 ' A' ' 728' ' ' LEU . 4.9 tt -57.86 -32.57 67.78 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.881 0.372 . . . . 0.0 110.925 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -65.63 -68.8 0.34 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.927 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.874 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 619' ' ' TRP . . . . . 0.444 ' CE2' ' HD2' ' A' ' 725' ' ' LYS . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.145 0 CA-C-O 120.53 0.205 . . . . 0.0 111.369 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 119.78 159.04 10.79 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.47 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -66.99 -40.9 10.9 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.578 2.186 . . . . 0.0 112.013 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 622' ' ' ASN . . . . . 0.656 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 11.9 m120 -64.61 -34.91 79.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.72 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 623' ' ' VAL . . . . . 0.417 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 38.6 t -72.98 -39.98 58.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.89 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 624' ' ' GLN . . . . . 0.567 ' CG ' HD11 ' A' ' 722' ' ' LEU . 3.1 tm0? -60.63 -41.18 94.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.709 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 6.6 mpt_? -67.0 -50.83 60.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.824 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 8.3 tt -62.01 -29.97 70.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.041 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 627' ' ' ALA . . . . . 0.411 ' HA ' ' HG2' ' A' ' 630' ' ' LYS . . . -70.98 -45.07 64.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.434 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -65.13 -38.85 91.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.262 -179.668 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 38.8 mt -66.8 -46.32 85.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.497 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 630' ' ' LYS . . . . . 0.456 ' HG3' ' N ' ' A' ' 631' ' ' LYS . 19.2 pttt -66.09 -32.6 74.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.798 0.332 . . . . 0.0 110.996 -179.819 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 631' ' ' LYS . . . . . 0.456 ' N ' ' HG3' ' A' ' 630' ' ' LYS . 0.0 OUTLIER -66.39 -44.76 82.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.991 0.424 . . . . 0.0 110.735 179.838 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 632' ' ' HIS . . . . . 0.847 ' CE1' HD21 ' A' ' 709' ' ' LEU . 86.2 t60 -71.3 -38.8 71.76 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.673 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.415 HD13 ' SD ' ' A' ' 640' ' ' MET . 47.6 mt -58.33 -49.8 75.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.016 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 634' ' ' ARG . . . . . 0.455 ' HG3' ' N ' ' A' ' 635' ' ' SER . 3.6 ptp180 -64.74 -40.32 95.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.866 0.365 . . . . 0.0 110.474 179.731 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 635' ' ' SER . . . . . 0.455 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 0.5 OUTLIER -73.86 -11.63 60.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.946 179.262 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 636' ' ' GLN . . . . . 0.409 ' HG3' ' NE2' ' A' ' 632' ' ' HIS . 33.4 mm-40 -98.6 -7.12 28.66 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.564 -179.639 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 114.05 -1.05 24.17 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.584 -0.817 . . . . 0.0 112.497 179.728 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 638' ' ' ILE . . . . . 0.409 HG21 ' CZ ' ' A' ' 702' ' ' TYR . 12.7 mt -108.11 104.77 17.61 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-O 120.635 0.255 . . . . 0.0 111.341 -179.4 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.6 121.19 21.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.825 0.345 . . . . 0.0 111.02 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 640' ' ' MET . . . . . 0.415 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.9 ttp -133.56 28.74 3.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.87 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -69.22 -30.71 68.94 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.913 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -71.61 -78.21 0.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.817 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 2.5 pp -179.93 128.37 0.24 Allowed Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.827 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 644' ' ' PRO . . . . . 0.543 ' HB2' HD11 ' A' ' 651' ' ' LEU . 64.6 Cg_endo -73.75 132.72 17.57 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.397 2.065 . . . . 0.0 112.289 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 645' ' ' LEU . . . . . 0.611 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.9 tp -123.67 151.73 42.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.192 0.52 . . . . 0.0 111.276 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 646' ' ' ILE . . . . . 0.81 HD11 ' HA ' ' A' ' 695' ' ' LEU . 0.7 OUTLIER -149.68 133.41 8.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.979 179.108 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 54.93 37.7 63.18 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.365 -0.922 . . . . 0.0 112.228 -179.428 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.89 7.66 66.64 Favored Glycine 0 C--N 1.332 0.335 0 C-N-CA 120.942 -0.647 . . . . 0.0 113.563 179.484 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.9 m -134.36 164.38 27.56 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 117.35 0.575 . . . . 0.0 111.417 -179.233 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 650' ' ' GLU . . . . . 0.611 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.3 OUTLIER -77.69 145.67 36.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.757 179.789 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 651' ' ' LEU . . . . . 0.615 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.93 145.15 47.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.384 -179.71 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -98.3 111.93 24.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.888 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -52.16 -35.74 49.53 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.056 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 654' ' ' ALA . . . . . 0.656 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -68.61 -44.93 73.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.115 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 10.7 t -67.99 -36.73 80.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.656 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 656' ' ' PHE . . . . . 0.581 ' HD2' HD23 ' A' ' 651' ' ' LEU . 0.1 OUTLIER -68.46 -44.47 74.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.826 179.908 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 56.6 t80 -58.69 -48.73 80.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.904 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 1.4 ttm180 -59.31 -43.03 92.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.99 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 659' ' ' LEU . . . . . 0.67 HD11 ' CE ' ' A' ' 681' ' ' MET . 0.2 OUTLIER -56.22 -49.71 73.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.145 -179.835 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 660' ' ' ILE . . . . . 0.604 HG23 HG21 ' A' ' 669' ' ' VAL . 16.9 mt -57.43 -44.71 85.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.821 0.343 . . . . 0.0 110.786 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -65.31 -47.52 76.28 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.271 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -55.5 -20.44 12.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.747 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.82 19.6 3.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.517 0.199 . . . . 0.0 111.508 -179.837 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 90.84 -18.19 51.73 Favored Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.562 -0.827 . . . . 0.0 112.725 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 665' ' ' GLY . . . . . 0.422 ' O ' HG23 ' A' ' 669' ' ' VAL . . . 147.37 175.34 20.12 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.369 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 666' ' ' MET . . . . . 0.507 ' O ' HG22 ' A' ' 670' ' ' THR . 0.0 OUTLIER -72.04 -36.69 69.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.898 0.38 . . . . 0.0 111.067 -179.928 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 667' ' ' GLN . . . . . 0.405 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 10.4 pt20 -56.08 -42.78 77.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.255 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 668' ' ' GLN . . . . . 0.549 ' HG3' HD11 ' A' ' 672' ' ' LEU . 0.0 OUTLIER -65.07 -45.14 86.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.956 0.408 . . . . 0.0 110.82 -179.988 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 669' ' ' VAL . . . . . 0.604 HG21 HG23 ' A' ' 660' ' ' ILE . 57.7 t -57.64 -55.71 19.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.564 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 670' ' ' THR . . . . . 0.507 HG22 ' O ' ' A' ' 666' ' ' MET . 9.7 t -76.04 -54.18 7.24 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.219 0.822 . . . . 0.0 113.219 -178.539 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 671' ' ' ASP . . . . . 0.507 ' N ' HG23 ' A' ' 670' ' ' THR . 7.1 t0 -56.21 -51.11 69.26 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -178.328 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 672' ' ' LEU . . . . . 0.549 HD11 ' HG3' ' A' ' 668' ' ' GLN . 28.0 mt -75.0 -1.81 24.36 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -179.117 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 11.3 mttp 50.46 84.15 0.04 OUTLIER 'General case' 0 CA--C 1.521 -0.151 0 CA-C-O 121.098 0.475 . . . . 0.0 110.371 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 5.6 tptm -148.73 21.63 1.01 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.138 -179.776 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 675' ' ' TRP . . . . . 1.114 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 27.5 m95 -56.26 -29.8 61.58 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 121.469 0.652 . . . . 0.0 109.996 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -56.45 -41.5 76.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.633 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.39 -51.75 10.29 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -179.309 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 1.02 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -57.32 -39.81 76.6 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.747 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 679' ' ' ALA . . . . . 0.822 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.56 -34.64 70.16 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.45 179.053 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -53.59 -47.78 69.82 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.267 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 681' ' ' MET . . . . . 0.67 ' CE ' HD11 ' A' ' 659' ' ' LEU . 0.0 OUTLIER -65.89 -21.55 66.46 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.779 179.306 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 682' ' ' LEU . . . . . 0.473 HD23 ' O ' ' A' ' 678' ' ' LEU . 3.1 mm? -78.28 -2.85 39.94 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.46 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 683' ' ' ARG . . . . . 0.691 ' C ' HD12 ' A' ' 684' ' ' ILE . 0.5 OUTLIER 71.66 71.79 0.17 Allowed 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.928 0.394 . . . . 0.0 111.251 179.842 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 684' ' ' ILE . . . . . 0.691 HD12 ' C ' ' A' ' 683' ' ' ARG . 2.1 mp -124.67 135.57 26.81 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.368 179.701 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -64.92 124.58 13.31 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.563 2.176 . . . . 0.0 112.506 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.79 -17.27 63.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.294 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.42 -24.0 67.09 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.702 0.287 . . . . 0.0 111.237 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 688' ' ' ALA . . . . . 0.423 ' HB3' ' HD3' ' A' ' 691' ' ' ARG . . . -79.31 112.28 16.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.921 0.391 . . . . 0.0 110.873 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -72.39 -68.35 0.48 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.329 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.44 -12.9 0.78 Allowed 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -179.153 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 691' ' ' ARG . . . . . 0.673 ' HG2' HD22 ' A' ' 692' ' ' LEU . 43.5 ptt85 -47.95 -42.79 28.41 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 120.919 0.39 . . . . 0.0 111.076 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 692' ' ' LEU . . . . . 0.673 HD22 ' HG2' ' A' ' 691' ' ' ARG . 2.5 mm? -60.99 -46.95 88.67 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.041 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.28 -39.0 68.67 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.886 0.375 . . . . 0.0 111.242 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 2.4 mttm -64.45 -38.73 92.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.246 179.676 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 1.114 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.9 OUTLIER -67.09 -44.23 80.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.488 179.756 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.443 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 4.2 mm-40 -55.43 -48.03 75.06 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.011 0.434 . . . . 0.0 110.816 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -76.82 -29.45 55.96 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.01 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 698' ' ' ALA . . . . . 0.433 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.35 -37.87 83.93 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.675 -179.733 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 699' ' ' TYR . . . . . 0.503 ' CZ ' ' HE3' ' A' ' 666' ' ' MET . 1.3 p90 -84.34 -35.08 23.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.892 0.377 . . . . 0.0 110.691 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 700' ' ' CYS . . . . . . . . . . . . . 28.8 t -64.86 -30.54 71.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.956 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -98.56 -2.41 38.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.581 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 702' ' ' TYR . . . . . 0.433 ' CD1' ' O ' ' A' ' 698' ' ' ALA . 4.8 m-85 -118.44 -78.83 0.59 Allowed 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.85 0.357 . . . . 0.0 111.343 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 90.9 mt -59.82 -40.86 89.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.636 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.424 HD23 ' CD1' ' A' ' 699' ' ' TYR . 0.8 OUTLIER -58.23 -55.34 36.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.92 0.39 . . . . 0.0 111.252 -179.682 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.57 -54.94 34.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.046 -179.656 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 706' ' ' TYR . . . . . 0.414 ' HA ' ' CD1' ' A' ' 709' ' ' LEU . 77.0 t80 -58.4 -50.32 74.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.206 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.78 -27.12 64.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.28 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 18.0 p -79.45 -16.88 55.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.178 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 709' ' ' LEU . . . . . 0.847 HD21 ' CE1' ' A' ' 632' ' ' HIS . 63.1 mt -53.37 147.34 10.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.935 0.398 . . . . 0.0 111.484 -179.826 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 710' ' ' SER . . . . . 0.454 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.4 OUTLIER -76.32 169.03 22.88 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.476 179.492 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 711' ' ' PRO . . . . . 0.454 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 15.9 Cg_endo -57.48 -21.61 46.58 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.473 2.115 . . . . 0.0 112.531 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 712' ' ' GLU . . . . . 0.419 ' O ' ' HG3' ' A' ' 715' ' ' ARG . 8.7 pt-20 -70.53 -53.6 15.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.056 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 713' ' ' GLU . . . . . 0.477 ' HB2' ' HB3' ' A' ' 709' ' ' LEU . 5.3 mm-40 -59.17 -26.05 64.44 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.521 -0.308 . . . . 0.0 111.125 -179.843 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 11.6 m-70 -75.91 -54.25 7.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.038 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 715' ' ' ARG . . . . . 0.419 ' HG3' ' O ' ' A' ' 712' ' ' GLU . 0.0 OUTLIER -64.1 -32.88 74.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.654 -179.243 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 7.9 mtt-85 -77.15 -54.22 6.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.926 0.393 . . . . 0.0 111.209 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 717' ' ' LEU . . . . . 0.494 ' O ' HG23 ' A' ' 721' ' ' VAL . 63.8 mt -62.74 -40.29 96.78 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.802 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 718' ' ' GLU . . . . . 0.722 ' HG2' HD22 ' A' ' 722' ' ' LEU . 16.8 tt0 -65.24 -54.59 27.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.637 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 719' ' ' LYS . . . . . 0.409 ' CG ' ' O ' ' A' ' 715' ' ' ARG . 0.7 OUTLIER -51.07 -36.76 41.76 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.425 -179.622 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 720' ' ' GLU . . . . . 0.417 ' O ' ' HG2' ' A' ' 723' ' ' MET . 2.3 mt-10 -67.36 -55.78 12.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.977 0.418 . . . . 0.0 110.653 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 721' ' ' VAL . . . . . 0.494 HG23 ' O ' ' A' ' 717' ' ' LEU . 39.5 t -61.92 -54.16 38.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.076 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 722' ' ' LEU . . . . . 0.722 HD22 ' HG2' ' A' ' 718' ' ' GLU . 4.6 mp -48.95 -45.67 42.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.858 -179.155 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 723' ' ' MET . . . . . 0.615 ' O ' HD12 ' A' ' 727' ' ' ILE . 15.7 ptp -73.11 -42.0 63.41 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 120.464 -0.495 . . . . 0.0 109.859 179.314 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 724' ' ' GLU . . . . . 0.4 ' N ' ' HG3' ' A' ' 723' ' ' MET . 2.2 mm-40 -54.23 -31.24 52.83 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.31 -179.779 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 725' ' ' LYS . . . . . 0.444 ' HD2' ' CE2' ' A' ' 619' ' ' TRP . 3.5 pttm -86.16 -36.61 19.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.335 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 726' ' ' GLU . . . . . 0.426 ' N ' ' HG3' ' A' ' 725' ' ' LYS . 4.9 mt-10 -71.65 -52.86 15.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.911 0.386 . . . . 0.0 111.124 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 727' ' ' ILE . . . . . 0.615 HD12 ' O ' ' A' ' 723' ' ' MET . 3.7 mp -87.63 11.66 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.68 -179.77 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.73 -48.96 79.39 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.745 0.307 . . . . 0.0 111.101 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -57.34 -32.46 66.75 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.1 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.197 -0.906 . . . . 0.0 110.884 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 619' ' ' TRP . . . . . 0.462 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.1 OUTLIER . . . . . 0 CA--C 1.528 0.131 0 CA-C-O 120.556 0.217 . . . . 0.0 111.565 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 122.42 157.9 10.09 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.42 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -68.84 -36.21 14.07 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.549 2.166 . . . . 0.0 112.025 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 54.9 m-80 -71.87 -30.91 65.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.696 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 623' ' ' VAL . . . . . 0.462 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 38.5 t -75.76 -37.49 35.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.617 179.583 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 624' ' ' GLN . . . . . 0.648 ' CG ' HD11 ' A' ' 722' ' ' LEU . 0.9 OUTLIER -66.39 -43.49 85.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.578 179.758 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 6.3 mmt85 -63.43 -50.45 69.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.567 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 626' ' ' LEU . . . . . 0.505 HD23 ' O ' ' A' ' 626' ' ' LEU . 2.8 tt -61.06 -35.17 76.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.74 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 627' ' ' ALA . . . . . 0.441 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -72.22 -46.06 57.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.204 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -58.39 -46.81 85.65 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.094 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 629' ' ' ILE . . . . . 0.424 HG21 HD23 ' A' ' 653' ' ' LEU . 31.2 mt -66.75 -37.71 80.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.09 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.11 -48.46 81.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.883 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 631' ' ' LYS . . . . . 0.45 ' HD2' HG22 ' A' ' 721' ' ' VAL . 0.8 OUTLIER -63.47 -40.5 97.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.009 -179.945 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 632' ' ' HIS . . . . . 0.621 ' HB2' HD13 ' A' ' 717' ' ' LEU . 67.8 t60 -66.51 -43.78 84.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.829 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.459 HD13 ' SD ' ' A' ' 640' ' ' MET . 49.7 mt -56.38 -49.92 73.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.175 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 634' ' ' ARG . . . . . 0.435 ' HG3' ' N ' ' A' ' 635' ' ' SER . 0.9 OUTLIER -60.82 -40.64 93.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.813 0.339 . . . . 0.0 110.717 179.914 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 635' ' ' SER . . . . . 0.435 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 49.1 m -73.74 -19.52 60.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.024 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -90.08 -10.46 44.65 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.586 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 119.07 -7.04 12.97 Favored Glycine 0 C--N 1.331 0.298 0 C-N-CA 120.613 -0.804 . . . . 0.0 112.524 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 638' ' ' ILE . . . . . 0.653 ' N ' HD12 ' A' ' 638' ' ' ILE . 3.6 mp -101.18 104.62 16.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.669 0.271 . . . . 0.0 111.143 -179.662 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 1.6 m -78.34 108.14 11.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.895 0.379 . . . . 0.0 110.869 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 640' ' ' MET . . . . . 0.459 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.9 mtp -122.33 28.61 7.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.98 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -61.0 -31.38 70.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.853 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 51.8 mm-40 -72.39 -78.23 0.09 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.865 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 1.1 pp -177.37 138.54 0.42 Allowed Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.888 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 644' ' ' PRO . . . . . 0.448 ' HB2' HD11 ' A' ' 651' ' ' LEU . 74.2 Cg_endo -75.65 136.92 19.71 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.562 2.175 . . . . 0.0 112.379 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 645' ' ' LEU . . . . . 0.659 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.6 tp -133.75 150.95 51.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.245 0.545 . . . . 0.0 111.267 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 646' ' ' ILE . . . . . 0.61 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.4 tt -149.82 133.93 8.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.702 178.846 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.15 39.95 58.77 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.319 -0.943 . . . . 0.0 112.429 -179.416 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.03 7.14 61.86 Favored Glycine 0 C--N 1.333 0.381 0 C-N-CA 120.904 -0.665 . . . . 0.0 113.799 179.242 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -133.57 164.26 27.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 117.396 0.598 . . . . 0.0 111.374 -179.403 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 650' ' ' GLU . . . . . 0.659 ' HA ' HD12 ' A' ' 645' ' ' LEU . 3.2 mt-10 -79.33 144.35 34.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.748 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 651' ' ' LEU . . . . . 0.624 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.59 144.99 48.25 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.306 -179.745 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 652' ' ' ASP . . . . . 0.493 ' OD1' ' HB3' ' A' ' 654' ' ' ALA . 10.9 t0 -94.81 105.09 17.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.932 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 653' ' ' LEU . . . . . 0.424 HD23 HG21 ' A' ' 629' ' ' ILE . 5.6 mp -53.88 -38.69 65.02 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.975 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 654' ' ' ALA . . . . . 0.493 ' HB3' ' OD1' ' A' ' 652' ' ' ASP . . . -63.57 -43.16 97.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.982 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 1.7 t -69.82 -31.66 69.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.465 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 656' ' ' PHE . . . . . 0.534 ' HD2' HD23 ' A' ' 651' ' ' LEU . 0.1 OUTLIER -72.42 -44.66 62.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.827 179.789 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -59.75 -48.47 81.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.843 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.75 -43.3 99.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.112 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 659' ' ' LEU . . . . . 0.688 HD13 ' CD2' ' A' ' 682' ' ' LEU . 0.3 OUTLIER -59.57 -49.38 78.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.404 -179.648 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 660' ' ' ILE . . . . . 0.79 HG23 HG21 ' A' ' 669' ' ' VAL . 85.6 mt -56.75 -45.64 82.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.793 0.33 . . . . 0.0 110.993 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -65.76 -44.23 86.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.109 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -64.16 -32.47 74.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.159 -179.732 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 663' ' ' MET . . . . . 0.467 ' CE ' HG22 ' A' ' 669' ' ' VAL . 1.2 mtm -72.73 -9.6 58.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.479 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 119.27 38.38 0.74 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.339 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 75.93 173.16 34.54 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.718 -0.754 . . . . 0.0 112.428 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 666' ' ' MET . . . . . 0.556 ' O ' HG22 ' A' ' 670' ' ' THR . 10.5 tpt -66.45 -41.67 88.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.682 0.277 . . . . 0.0 111.366 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 667' ' ' GLN . . . . . 0.427 ' O ' ' HB2' ' A' ' 671' ' ' ASP . 13.3 pt20 -50.37 -46.66 56.1 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -179.157 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 668' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -50.78 69.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.887 0.375 . . . . 0.0 111.059 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 669' ' ' VAL . . . . . 0.79 HG21 HG23 ' A' ' 660' ' ' ILE . 48.9 t -55.74 -55.5 17.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.911 -179.748 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 670' ' ' THR . . . . . 0.587 HG23 ' OD1' ' A' ' 671' ' ' ASP . 15.2 t -75.95 -52.45 10.25 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -178.007 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 671' ' ' ASP . . . . . 0.587 ' OD1' HG23 ' A' ' 670' ' ' THR . 0.8 OUTLIER -60.79 -50.97 71.33 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -178.203 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 26.3 mt -76.39 1.61 15.84 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 2.3 mttm 49.86 82.96 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.021 0.439 . . . . 0.0 110.266 -179.754 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 1.4 ttmp? -142.73 23.73 1.91 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.304 -179.552 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 675' ' ' TRP . . . . . 1.113 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 37.8 m95 -62.4 -27.64 69.23 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.337 0.589 . . . . 0.0 110.211 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -57.67 -45.48 85.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.482 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.01 -51.61 13.17 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.742 0.306 . . . . 0.0 111.445 -179.382 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.981 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -56.01 -40.55 73.55 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 179.624 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 679' ' ' ALA . . . . . 0.83 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.71 -31.87 67.2 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.496 179.18 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.18 -49.69 71.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.194 179.59 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 681' ' ' MET . . . . . 0.534 ' CE ' HD11 ' A' ' 659' ' ' LEU . 1.9 ttm -62.38 -21.44 65.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.603 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 682' ' ' LEU . . . . . 0.688 ' CD2' HD13 ' A' ' 659' ' ' LEU . 3.4 mm? -80.55 -1.51 42.28 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.371 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 683' ' ' ARG . . . . . 0.64 ' C ' HD12 ' A' ' 684' ' ' ILE . 10.3 mmm180 68.84 71.77 0.28 Allowed 'General case' 0 N--CA 1.462 0.126 0 CA-C-O 120.936 0.398 . . . . 0.0 110.861 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 684' ' ' ILE . . . . . 0.64 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.7 mp -118.78 136.48 24.23 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.926 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.52 123.68 11.43 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.486 2.124 . . . . 0.0 112.272 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -16.85 63.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.387 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.29 -23.79 67.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.01 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 688' ' ' ALA . . . . . 0.495 ' HB1' ' HB2' ' A' ' 691' ' ' ARG . . . -84.51 106.08 15.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.846 0.355 . . . . 0.0 110.95 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -73.17 -68.56 0.48 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.325 -179.576 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -51.97 -19.76 2.0 Allowed 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -179.405 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 691' ' ' ARG . . . . . 0.495 ' HB2' ' HB1' ' A' ' 688' ' ' ALA . 0.0 OUTLIER -46.2 -39.43 9.74 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.789 0.328 . . . . 0.0 111.223 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -58.61 -45.35 89.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.844 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.11 -37.51 69.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.99 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.8 -40.85 97.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.224 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 1.113 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.3 OUTLIER -65.44 -44.31 87.71 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.18 179.499 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.431 ' O ' ' CD2' ' A' ' 699' ' ' TYR . 42.9 tt0 -55.76 -45.88 77.98 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.884 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.25 -29.89 54.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.041 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 698' ' ' ALA . . . . . 0.449 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -66.42 -37.58 85.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.483 -179.757 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 699' ' ' TYR . . . . . 0.527 ' CZ ' ' HE2' ' A' ' 666' ' ' MET . 1.7 p90 -86.04 -33.92 20.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.074 0.464 . . . . 0.0 110.233 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 700' ' ' CYS . . . . . 0.543 ' HA ' HD23 ' A' ' 704' ' ' LEU . 1.4 m -63.1 -30.53 71.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.867 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -100.97 -1.81 33.44 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.478 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 702' ' ' TYR . . . . . 0.554 ' CE2' HG21 ' A' ' 638' ' ' ILE . 4.5 m-85 -117.57 -75.94 0.58 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.94 0.4 . . . . 0.0 111.4 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 20.2 mt -64.27 -41.73 96.78 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.812 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.543 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.4 OUTLIER -47.92 -56.91 6.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.848 0.356 . . . . 0.0 111.431 -179.496 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 1.4 m -54.64 -46.44 73.93 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.27 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 706' ' ' TYR . . . . . 0.608 ' O ' HD22 ' A' ' 709' ' ' LEU . 67.7 t80 -63.43 -29.47 70.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.346 -179.699 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -96.92 -2.47 43.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.709 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 57.8 m -113.2 -21.57 10.93 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.727 0.298 . . . . 0.0 111.36 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 709' ' ' LEU . . . . . 0.664 HD23 ' O ' ' A' ' 709' ' ' LEU . 0.2 OUTLIER -69.56 171.54 8.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.885 179.981 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -72.66 164.29 61.36 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.008 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.26 -29.88 54.81 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.544 2.163 . . . . 0.0 111.959 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -51.07 -50.81 57.97 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.75 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 713' ' ' GLU . . . . . 0.453 ' HB2' ' CD1' ' A' ' 709' ' ' LEU . 1.6 mm-40 -58.26 -28.21 64.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.935 179.758 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 714' ' ' HIS . . . . . 0.535 ' CD2' HD21 ' A' ' 709' ' ' LEU . 1.7 m170 -76.02 -54.01 7.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.583 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.68 -44.64 96.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.37 -179.59 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 2.0 mtp-105 -65.66 -54.16 31.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.273 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 717' ' ' LEU . . . . . 0.621 HD13 ' HB2' ' A' ' 632' ' ' HIS . 76.8 mt -62.98 -41.13 99.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.787 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 718' ' ' GLU . . . . . 0.65 ' HG3' HD13 ' A' ' 722' ' ' LEU . 30.3 tt0 -66.82 -54.12 25.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.3 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.74 -34.62 27.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.347 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 720' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' A' ' 723' ' ' MET . 6.0 mt-10 -68.54 -55.63 11.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.009 0.433 . . . . 0.0 110.428 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 721' ' ' VAL . . . . . 0.45 HG22 ' HD2' ' A' ' 631' ' ' LYS . 44.7 t -61.55 -53.66 45.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.808 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 722' ' ' LEU . . . . . 0.65 HD13 ' HG3' ' A' ' 718' ' ' GLU . 3.6 mp -48.69 -46.43 40.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.884 -179.31 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 723' ' ' MET . . . . . 0.564 ' HB2' HD13 ' A' ' 727' ' ' ILE . 16.5 ptp -71.49 -41.01 69.85 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.566 -0.454 . . . . 0.0 109.873 179.399 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 724' ' ' GLU . . . . . 0.417 ' N ' ' HG3' ' A' ' 723' ' ' MET . 1.9 mm-40 -53.48 -32.8 51.79 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.403 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 725' ' ' LYS . . . . . 0.456 ' HD3' ' CE2' ' A' ' 619' ' ' TRP . 8.7 pttt -86.18 -41.92 14.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.314 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 726' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 722' ' ' LEU . 13.7 mt-10 -66.23 -54.0 30.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.882 0.373 . . . . 0.0 111.147 -179.763 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 727' ' ' ILE . . . . . 0.631 ' O ' HG22 ' A' ' 727' ' ' ILE . 4.3 mp -86.94 11.51 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.746 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 1.7 tt -57.65 -42.15 82.88 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.817 0.342 . . . . 0.0 111.168 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -59.62 -51.06 71.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.123 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 730' ' ' LYS . . . . . 0.49 ' HD3' HG23 ' A' ' 727' ' ' ILE . 9.4 mtpt . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.861 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 619' ' ' TRP . . . . . 0.535 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.131 0 CA-C-O 120.645 0.259 . . . . 0.0 111.29 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 120.57 169.14 13.84 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.489 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -68.15 -38.71 11.8 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.59 2.193 . . . . 0.0 112.174 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 622' ' ' ASN . . . . . 0.533 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 59.5 m-80 -62.46 -42.64 99.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.93 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 623' ' ' VAL . . . . . 0.464 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 40.5 t -72.15 -35.01 51.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.845 179.704 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 624' ' ' GLN . . . . . 0.603 ' CG ' HD11 ' A' ' 722' ' ' LEU . 0.9 OUTLIER -57.7 -47.32 82.69 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.766 179.882 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.69 -43.5 75.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.796 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 626' ' ' LEU . . . . . 0.545 HD23 ' O ' ' A' ' 626' ' ' LEU . 6.2 tt -59.7 -36.93 77.51 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.971 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 627' ' ' ALA . . . . . 0.455 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -72.77 -46.29 54.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.293 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.17 -46.82 82.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.054 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 23.5 mt -66.63 -40.04 85.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.122 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 6.1 ttpt -62.9 -49.41 74.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.905 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 631' ' ' LYS . . . . . 0.478 ' HD2' HG22 ' A' ' 721' ' ' VAL . 2.7 tttm -58.13 -42.57 86.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.036 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 632' ' ' HIS . . . . . 0.74 ' HB2' HD13 ' A' ' 717' ' ' LEU . 79.9 t60 -68.27 -41.92 80.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.974 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.592 HD13 ' SD ' ' A' ' 640' ' ' MET . 39.1 mt -56.04 -47.41 77.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.21 -179.69 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 1.7 ptt180 -65.43 -41.75 93.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.77 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.78 -13.57 60.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.304 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 636' ' ' GLN . . . . . 0.45 ' CG ' ' CE1' ' A' ' 632' ' ' HIS . 22.7 mm100 -96.21 -9.46 30.41 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.619 -179.658 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 118.89 -9.86 12.3 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.595 -0.812 . . . . 0.0 112.371 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 638' ' ' ILE . . . . . 0.638 ' N ' HD12 ' A' ' 638' ' ' ILE . 3.5 mp -98.79 104.75 16.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.708 0.29 . . . . 0.0 111.074 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -80.61 116.08 20.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.963 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 640' ' ' MET . . . . . 0.592 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.5 ttp -124.26 16.66 9.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.182 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.79 -31.21 62.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.839 0.352 . . . . 0.0 111.036 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -70.91 -73.67 0.17 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.786 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 1.9 pp -179.73 130.77 0.25 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.749 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.11 124.79 9.81 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.432 2.088 . . . . 0.0 112.287 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 645' ' ' LEU . . . . . 0.644 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.8 tp -127.36 152.76 47.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.28 0.562 . . . . 0.0 111.323 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 646' ' ' ILE . . . . . 0.483 HG22 ' HB3' ' A' ' 651' ' ' LEU . 4.4 tt -149.65 133.42 8.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.486 178.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 50.71 43.01 46.46 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.25 -0.976 . . . . 0.0 112.212 -179.31 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 68.86 6.77 53.44 Favored Glycine 0 CA--C 1.52 0.39 0 C-N-CA 121.068 -0.587 . . . . 0.0 113.908 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 62.4 m -130.9 161.97 30.69 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 117.609 0.705 . . . . 0.0 111.636 -179.072 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 650' ' ' GLU . . . . . 0.644 ' HA ' HD12 ' A' ' 645' ' ' LEU . 10.3 mt-10 -80.41 142.57 34.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.759 179.76 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 651' ' ' LEU . . . . . 0.638 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -135.16 145.3 47.64 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.298 -179.742 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -96.36 111.64 23.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.787 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -51.97 -38.94 58.41 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.029 -179.792 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 654' ' ' ALA . . . . . 0.533 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -65.04 -44.35 89.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.055 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -68.55 -33.9 74.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.862 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 656' ' ' PHE . . . . . 0.432 ' CE2' ' HG ' ' A' ' 682' ' ' LEU . 0.7 OUTLIER -72.88 -45.16 59.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.853 -179.96 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -61.39 -46.48 89.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.725 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.96 -45.32 95.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.816 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 659' ' ' LEU . . . . . 0.622 HD12 ' HB2' ' A' ' 678' ' ' LEU . 0.2 OUTLIER -56.62 -48.76 76.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.933 -179.975 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 660' ' ' ILE . . . . . 0.746 HG21 ' HG2' ' A' ' 666' ' ' MET . 76.9 mt -58.2 -45.48 88.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.927 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 14.4 m-20 -64.74 -46.54 81.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.231 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.38 -40.71 71.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.179 -179.733 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 663' ' ' MET . . . . . 0.401 ' HE1' ' N ' ' A' ' 678' ' ' LEU . 0.0 OUTLIER -65.95 -27.22 68.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.028 -179.983 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 131.69 46.98 0.12 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.347 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 75.99 176.45 40.81 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.505 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 666' ' ' MET . . . . . 0.746 ' HG2' HG21 ' A' ' 660' ' ' ILE . 0.0 OUTLIER -73.11 -30.58 63.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.768 0.318 . . . . 0.0 111.109 -179.975 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 667' ' ' GLN . . . . . 0.423 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 4.3 pt20 -57.25 -45.77 83.67 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.641 -179.499 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 668' ' ' GLN . . . . . 0.466 ' HA ' HD13 ' A' ' 672' ' ' LEU . 0.0 OUTLIER -66.5 -52.76 42.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.838 0.351 . . . . 0.0 111.336 -179.615 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 669' ' ' VAL . . . . . 0.728 HG21 HG23 ' A' ' 660' ' ' ILE . 66.8 t -49.51 -54.97 5.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.572 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 670' ' ' THR . . . . . 0.613 HG22 ' O ' ' A' ' 666' ' ' MET . 12.3 t -76.18 -49.59 16.8 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 -178.407 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 671' ' ' ASP . . . . . 0.471 ' N ' HG23 ' A' ' 670' ' ' THR . 7.9 t70 -62.95 -51.16 67.96 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -177.856 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 672' ' ' LEU . . . . . 0.466 HD13 ' HA ' ' A' ' 668' ' ' GLN . 10.7 mp -79.04 3.6 16.85 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -179.04 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 14.7 ttmm 48.56 84.81 0.03 OUTLIER 'General case' 0 C--O 1.231 0.13 0 CA-C-O 120.971 0.415 . . . . 0.0 110.507 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt -145.06 22.9 1.54 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.24 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 675' ' ' TRP . . . . . 1.087 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 39.4 m95 -61.24 -28.63 69.3 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 121.397 0.617 . . . . 0.0 110.112 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 -56.9 -43.9 81.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.484 -179.681 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.14 -51.52 12.0 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.755 0.312 . . . . 0.0 111.44 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.969 HD22 ' HA ' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.59 -40.39 71.98 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 179.645 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 679' ' ' ALA . . . . . 0.835 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.83 -33.61 68.62 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.513 179.074 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.33 -49.5 66.96 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.211 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 19.9 mtm -62.92 -22.62 66.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.67 179.257 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 682' ' ' LEU . . . . . 0.477 HD23 ' O ' ' A' ' 678' ' ' LEU . 3.5 mm? -79.53 -1.23 36.74 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.333 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 683' ' ' ARG . . . . . 0.667 ' C ' HD12 ' A' ' 684' ' ' ILE . 0.2 OUTLIER 69.38 71.81 0.25 Allowed 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 120.951 0.405 . . . . 0.0 111.065 -179.83 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 684' ' ' ILE . . . . . 0.667 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.7 mp -119.81 135.7 24.39 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.72 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.99 123.16 10.9 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.411 2.074 . . . . 0.0 112.375 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -16.4 63.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.167 179.853 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.46 -23.74 66.99 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.12 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 688' ' ' ALA . . . . . 0.422 ' CB ' ' HB2' ' A' ' 691' ' ' ARG . . . -85.25 105.36 15.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.834 0.349 . . . . 0.0 111.011 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 -70.32 -68.35 0.43 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.141 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -53.33 -17.8 2.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.909 -179.563 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 691' ' ' ARG . . . . . 0.61 ' NE ' HG23 ' A' ' 684' ' ' ILE . 0.0 OUTLIER -46.82 -35.25 6.08 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.905 0.383 . . . . 0.0 111.143 179.904 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 692' ' ' LEU . . . . . 0.413 HD13 ' HA ' ' A' ' 692' ' ' LEU . 3.8 mm? -66.28 -40.74 90.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.869 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.11 -37.65 69.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.889 179.659 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 20.9 mmtt -64.3 -40.66 96.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.173 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 1.087 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.8 OUTLIER -64.83 -44.55 89.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.377 179.545 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.445 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 3.1 mt-30 -55.42 -46.3 76.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.815 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.08 -29.63 55.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.132 179.888 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -67.49 -38.53 84.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.581 -179.808 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 699' ' ' TYR . . . . . 0.779 ' HB2' HD12 ' A' ' 703' ' ' LEU . 1.1 p90 -85.69 -31.82 22.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.948 0.404 . . . . 0.0 110.516 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 700' ' ' CYS . . . . . 0.43 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 1.6 m -65.77 -30.61 71.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.476 179.509 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -97.11 -8.47 30.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.37 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 702' ' ' TYR . . . . . 0.419 ' CE2' HG21 ' A' ' 638' ' ' ILE . 4.0 m-85 -113.47 -78.99 0.58 Allowed 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.829 0.347 . . . . 0.0 111.367 -179.659 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 703' ' ' LEU . . . . . 0.779 HD12 ' HB2' ' A' ' 699' ' ' TYR . 61.6 mt -56.17 -46.55 79.31 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.618 -179.441 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.452 HD23 ' CE1' ' A' ' 699' ' ' TYR . 1.0 OUTLIER -53.97 -48.62 70.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.901 0.382 . . . . 0.0 110.887 -179.928 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 705' ' ' SER . . . . . 0.638 ' O ' HD13 ' A' ' 709' ' ' LEU . 4.4 m -54.63 -54.97 34.54 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.347 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 706' ' ' TYR . . . . . 0.497 ' CE2' ' CE1' ' A' ' 714' ' ' HIS . 18.4 t80 -46.81 -43.59 18.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.787 -179.678 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -94.49 1.61 55.73 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 29.7 t -80.56 -20.29 43.74 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 709' ' ' LEU . . . . . 0.638 HD13 ' O ' ' A' ' 705' ' ' SER . 0.0 OUTLIER -94.62 -174.27 3.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.824 0.345 . . . . 0.0 111.46 -179.768 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 710' ' ' SER . . . . . 0.416 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.4 OUTLIER -85.3 167.06 27.54 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.965 -179.817 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 711' ' ' PRO . . . . . 0.416 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 18.8 Cg_endo -58.92 -17.86 39.44 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.608 2.205 . . . . 0.0 112.765 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -60.12 -52.75 64.02 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.8 0.333 . . . . 0.0 110.889 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 713' ' ' GLU . . . . . 0.436 ' O ' HD12 ' A' ' 717' ' ' LEU . 65.9 mm-40 -64.47 -25.88 68.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.955 179.752 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 714' ' ' HIS . . . . . 0.497 ' CE1' ' CE2' ' A' ' 706' ' ' TYR . 0.1 OUTLIER -74.91 -54.63 6.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.171 179.599 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 15.5 mmm180 -65.25 -36.21 83.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.274 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 18.6 mtt180 -65.52 -54.23 31.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.822 0.344 . . . . 0.0 110.993 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 717' ' ' LEU . . . . . 0.74 HD13 ' HB2' ' A' ' 632' ' ' HIS . 30.5 mt -62.77 -34.84 78.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.694 179.788 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 718' ' ' GLU . . . . . 0.703 ' HG2' HD22 ' A' ' 722' ' ' LEU . 27.0 tt0 -69.39 -53.9 17.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.394 179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -52.34 -34.09 45.72 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.432 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 720' ' ' GLU . . . . . 0.449 ' O ' ' HG2' ' A' ' 723' ' ' MET . 1.0 OUTLIER -69.35 -55.81 9.33 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.019 0.437 . . . . 0.0 110.389 179.775 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 721' ' ' VAL . . . . . 0.617 HG23 ' O ' ' A' ' 717' ' ' LEU . 21.5 t -61.8 -53.13 52.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.053 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 722' ' ' LEU . . . . . 0.703 HD22 ' HG2' ' A' ' 718' ' ' GLU . 6.9 mp -51.81 -42.49 62.54 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.009 -179.271 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 723' ' ' MET . . . . . 0.605 ' O ' HD12 ' A' ' 727' ' ' ILE . 14.2 ptp -71.91 -39.71 69.32 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.487 -0.485 . . . . 0.0 109.994 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 724' ' ' GLU . . . . . 0.416 ' N ' ' HG3' ' A' ' 723' ' ' MET . 1.4 mt-10 -56.29 -32.0 64.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.291 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 725' ' ' LYS . . . . . 0.457 ' HD3' ' CE2' ' A' ' 619' ' ' TRP . 7.5 pttt -86.15 -43.84 12.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.298 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -63.96 -48.43 76.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.922 0.392 . . . . 0.0 110.982 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 727' ' ' ILE . . . . . 0.654 ' O ' HG22 ' A' ' 727' ' ' ILE . 4.3 mp -89.46 11.57 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.526 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 1.5 tt -57.69 -34.52 69.51 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.794 0.33 . . . . 0.0 110.959 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -76.88 -53.08 8.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.953 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 3.1 mttt . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.935 179.979 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 619' ' ' TRP . . . . . 0.435 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.5 OUTLIER . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.777 0.322 . . . . 0.0 110.813 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . -55.99 170.58 2.22 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.468 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.76 -49.42 2.28 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.509 2.139 . . . . 0.0 112.09 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 622' ' ' ASN . . . . . 0.584 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 0.4 OUTLIER -58.61 -20.64 49.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.288 -179.938 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 623' ' ' VAL . . . . . 0.435 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 28.9 t -75.7 -45.93 37.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.911 0.386 . . . . 0.0 110.472 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.08 -43.81 94.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.163 179.341 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.06 -50.86 71.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.537 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 7.4 tt -62.54 -33.27 74.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.949 0.404 . . . . 0.0 110.542 179.551 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 627' ' ' ALA . . . . . 0.573 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -69.46 -46.83 65.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.267 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -62.28 -44.64 96.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.128 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 629' ' ' ILE . . . . . 0.467 ' HA ' ' CD2' ' A' ' 632' ' ' HIS . 14.6 mt -60.54 -45.08 97.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.99 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 630' ' ' LYS . . . . . 0.482 ' HA ' HD12 ' A' ' 633' ' ' LEU . 13.8 ttpt -64.13 -34.32 77.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.231 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.36 -48.03 74.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.641 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 632' ' ' HIS . . . . . 0.468 ' HB3' HD13 ' A' ' 717' ' ' LEU . 1.1 p80 -68.53 -37.83 80.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.823 0.344 . . . . 0.0 110.558 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.489 HD13 ' SD ' ' A' ' 640' ' ' MET . 32.1 mt -55.73 -49.95 71.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.121 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 634' ' ' ARG . . . . . 0.408 ' HG3' ' N ' ' A' ' 635' ' ' SER . 4.1 ptt180 -65.25 -40.99 94.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.78 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 635' ' ' SER . . . . . 0.408 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 1.4 m -73.75 -13.33 60.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.408 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 636' ' ' GLN . . . . . 0.587 HE22 HD21 ' A' ' 709' ' ' LEU . 0.0 OUTLIER -97.39 -6.56 33.79 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.661 -179.654 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 111.96 4.21 26.11 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.6 -0.809 . . . . 0.0 112.57 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 638' ' ' ILE . . . . . . . . . . . . . 17.7 mt -110.77 106.09 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-O 120.72 0.295 . . . . 0.0 111.238 -179.421 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.2 118.4 24.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.892 0.377 . . . . 0.0 110.816 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 640' ' ' MET . . . . . 0.489 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.5 ttp -121.45 23.01 10.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.174 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -58.08 -30.61 66.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.011 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -71.23 -79.49 0.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.853 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -178.36 133.82 0.31 Allowed Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.839 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -77.79 118.24 4.44 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.582 2.188 . . . . 0.0 112.388 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 645' ' ' LEU . . . . . 0.636 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.9 tp -118.58 152.55 35.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.226 0.536 . . . . 0.0 111.181 179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 646' ' ' ILE . . . . . 0.661 HD11 ' HA ' ' A' ' 695' ' ' LEU . 15.8 tt -149.67 133.88 8.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.828 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 52.28 40.24 52.59 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.363 -0.922 . . . . 0.0 112.239 -179.394 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.33 8.0 61.49 Favored Glycine 0 C--N 1.333 0.382 0 C-N-CA 120.913 -0.66 . . . . 0.0 113.686 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.2 m -133.51 163.3 29.68 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 117.366 0.583 . . . . 0.0 111.368 -179.298 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 650' ' ' GLU . . . . . 0.636 ' HA ' HD12 ' A' ' 645' ' ' LEU . 5.0 mt-10 -79.84 144.67 33.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.657 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 651' ' ' LEU . . . . . 0.615 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.62 145.07 48.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.352 -179.783 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -97.08 109.76 22.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.841 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 653' ' ' LEU . . . . . 0.561 HD12 ' CD2' ' A' ' 651' ' ' LEU . 5.7 mp -52.14 -37.84 55.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.004 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 654' ' ' ALA . . . . . 0.584 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -66.05 -44.05 85.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.174 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 5.7 t -69.9 -36.45 75.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.67 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 656' ' ' PHE . . . . . 0.435 ' CZ ' ' HG ' ' A' ' 682' ' ' LEU . 0.2 OUTLIER -70.93 -45.85 63.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.831 179.998 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -57.73 -50.57 72.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.993 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.87 -41.17 95.41 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.989 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 659' ' ' LEU . . . . . 0.843 HD22 HD23 ' A' ' 682' ' ' LEU . 0.1 OUTLIER -59.0 -49.85 76.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.111 -179.794 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 660' ' ' ILE . . . . . 0.783 HG23 HG21 ' A' ' 669' ' ' VAL . 62.8 mt -56.87 -46.14 83.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.767 0.318 . . . . 0.0 110.882 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -61.81 -38.08 86.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.016 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 51.6 tt0 -66.69 -14.73 62.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.422 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.16 33.59 1.72 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.824 0.345 . . . . 0.0 111.101 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 72.46 25.16 74.94 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.641 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 97.48 169.61 32.93 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.583 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 666' ' ' MET . . . . . 0.507 ' HE2' ' CE1' ' A' ' 699' ' ' TYR . 9.6 tpt -64.82 -37.47 87.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.703 0.287 . . . . 0.0 111.116 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 667' ' ' GLN . . . . . 0.448 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 16.0 pt20 -50.79 -44.13 58.76 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.308 -179.765 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 668' ' ' GLN . . . . . 0.472 ' HA ' HD13 ' A' ' 672' ' ' LEU . 0.0 OUTLIER -65.85 -52.74 47.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.903 0.382 . . . . 0.0 110.922 179.959 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 669' ' ' VAL . . . . . 0.783 HG21 HG23 ' A' ' 660' ' ' ILE . 48.4 t -49.57 -55.83 4.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.687 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 670' ' ' THR . . . . . 0.511 HG23 ' N ' ' A' ' 671' ' ' ASP . 14.0 t -76.27 -53.67 7.9 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.658 0.984 . . . . 0.0 113.658 -178.491 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 671' ' ' ASP . . . . . 0.511 ' N ' HG23 ' A' ' 670' ' ' THR . 6.3 t70 -58.56 -51.17 71.03 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -177.654 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 672' ' ' LEU . . . . . 0.472 HD13 ' HA ' ' A' ' 668' ' ' GLN . 9.1 mp -77.22 1.84 17.27 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -178.886 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 49.07 83.43 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.13 0.49 . . . . 0.0 110.532 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.18 22.7 1.36 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.646 -0.707 . . . . 0.0 110.981 -179.768 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 675' ' ' TRP . . . . . 1.121 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 29.3 m95 -58.47 -28.63 65.51 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 121.391 0.615 . . . . 0.0 110.204 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 14.8 m-80 -56.11 -41.59 75.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.895 -179.485 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 6.3 mmtp -77.8 -51.82 9.89 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 120.703 0.287 . . . . 0.0 111.66 -179.172 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 1.056 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -58.06 -40.86 82.07 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.862 -0.421 . . . . 0.0 109.862 179.689 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 679' ' ' ALA . . . . . 0.801 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.56 -33.76 69.38 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.423 179.028 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.74 -49.07 68.96 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.395 179.513 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 2.9 ttp -64.57 -22.37 66.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.906 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 682' ' ' LEU . . . . . 0.843 HD23 HD22 ' A' ' 659' ' ' LEU . 3.1 mm? -78.3 -2.99 40.7 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.446 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 683' ' ' ARG . . . . . 0.697 ' C ' HD12 ' A' ' 684' ' ' ILE . 37.7 mmt180 70.02 71.8 0.23 Allowed 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.979 0.418 . . . . 0.0 111.497 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 684' ' ' ILE . . . . . 0.697 HD12 ' C ' ' A' ' 683' ' ' ARG . 2.0 mp -122.22 141.9 35.59 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.073 179.401 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 685' ' ' PRO . . . . . 0.661 ' HD2' HG23 ' A' ' 684' ' ' ILE . 51.3 Cg_endo -69.67 119.42 6.37 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.511 2.141 . . . . 0.0 112.655 -179.563 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 8.3 mmmt -69.87 -21.89 63.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.095 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -65.35 -21.6 66.71 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.389 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 688' ' ' ALA . . . . . 0.758 ' HB3' ' HG2' ' A' ' 691' ' ' ARG . . . -72.58 115.75 12.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.873 0.368 . . . . 0.0 111.007 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 67.0 mm-40 -83.39 5.9 21.93 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.49 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -123.81 -15.19 7.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.946 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 691' ' ' ARG . . . . . 0.788 ' HG3' HD22 ' A' ' 692' ' ' LEU . 0.0 OUTLIER -53.42 -33.1 52.68 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-O 120.744 0.307 . . . . 0.0 110.951 -179.609 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 692' ' ' LEU . . . . . 0.788 HD22 ' HG3' ' A' ' 691' ' ' ARG . 3.2 mm? -70.57 -49.54 46.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.056 179.758 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.19 -39.65 68.46 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.501 -179.693 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 6.3 mtpt -64.01 -38.85 92.58 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.033 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 1.121 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 4.0 tp -65.08 -47.32 77.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.827 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.413 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 43.5 mt-30 -55.33 -46.8 76.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.105 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -76.95 -29.67 55.69 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.131 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 698' ' ' ALA . . . . . 0.415 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.97 -37.48 81.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.797 -179.506 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 699' ' ' TYR . . . . . 0.539 ' HB2' HD12 ' A' ' 703' ' ' LEU . 1.2 p90 -86.6 -33.5 20.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.032 0.444 . . . . 0.0 110.442 179.819 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 700' ' ' CYS . . . . . 0.513 ' HA ' HD23 ' A' ' 704' ' ' LEU . 1.8 m -65.78 -30.46 71.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.887 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -98.53 -1.52 40.92 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.549 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 702' ' ' TYR . . . . . 0.415 ' CD1' ' O ' ' A' ' 698' ' ' ALA . 7.6 m-85 -122.55 -75.94 0.59 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.791 0.329 . . . . 0.0 111.308 -179.87 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 703' ' ' LEU . . . . . 0.631 HD13 HD12 ' A' ' 660' ' ' ILE . 19.7 mt -56.0 -44.55 78.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.439 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.513 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.9 OUTLIER -54.84 -27.17 40.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.15 -179.91 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 705' ' ' SER . . . . . 0.441 ' HB3' ' CE1' ' A' ' 632' ' ' HIS . 0.2 OUTLIER -67.99 -55.52 12.37 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.557 179.901 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 706' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -53.15 -46.62 68.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.147 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -74.82 -19.42 60.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.526 -179.793 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 40.0 t -88.99 -35.21 16.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.767 0.318 . . . . 0.0 111.21 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 709' ' ' LEU . . . . . 0.587 HD21 HE22 ' A' ' 636' ' ' GLN . 71.8 mt -56.67 150.06 16.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.184 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 710' ' ' SER . . . . . 0.428 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.5 OUTLIER -75.7 166.82 42.1 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.8 179.953 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 711' ' ' PRO . . . . . 0.428 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 11.4 Cg_endo -54.8 -26.08 45.99 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.542 2.161 . . . . 0.0 112.334 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.84 -53.35 58.43 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.747 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 713' ' ' GLU . . . . . 0.457 ' O ' HD12 ' A' ' 717' ' ' LEU . 5.7 mm-40 -60.21 -26.21 66.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.033 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 17.4 m170 -75.83 -54.38 7.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.944 0.402 . . . . 0.0 110.471 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 17.0 mtt180 -60.56 -47.62 85.4 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.461 -179.618 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.93 -54.17 34.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.568 -179.394 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 717' ' ' LEU . . . . . 0.468 HD13 ' HB3' ' A' ' 632' ' ' HIS . 73.9 mt -62.38 -41.93 99.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.978 -179.738 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -65.95 -54.25 28.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.836 0.35 . . . . 0.0 110.2 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 1.5 mmpt? -50.42 -33.57 21.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.331 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 720' ' ' GLU . . . . . 0.426 ' O ' ' HG2' ' A' ' 723' ' ' MET . 12.7 mt-10 -69.25 -55.36 10.76 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.578 179.648 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 721' ' ' VAL . . . . . 0.573 HG11 ' HB1' ' A' ' 627' ' ' ALA . 25.2 t -64.06 -54.99 24.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.922 -179.828 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 722' ' ' LEU . . . . . 0.446 ' O ' ' HG3' ' A' ' 725' ' ' LYS . 1.1 mp -49.16 -43.37 41.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.724 -179.524 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 723' ' ' MET . . . . . 0.531 ' O ' HD12 ' A' ' 727' ' ' ILE . 8.0 ptp -73.85 -40.48 63.25 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.562 -0.455 . . . . 0.0 109.942 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -51.08 -38.06 49.43 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.532 -179.584 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 725' ' ' LYS . . . . . 0.446 ' HG3' ' O ' ' A' ' 722' ' ' LEU . 0.0 OUTLIER -86.08 -34.78 20.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.732 0.301 . . . . 0.0 111.088 -179.787 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -65.35 -54.33 30.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.026 0.441 . . . . 0.0 110.789 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 727' ' ' ILE . . . . . 0.62 ' O ' HG22 ' A' ' 727' ' ' ILE . 4.1 mp -88.48 11.49 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.539 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 2.7 tt -59.12 -48.0 83.2 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.833 0.349 . . . . 0.0 111.094 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -60.51 -50.05 75.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.097 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 730' ' ' LYS . . . . . 0.405 ' HD2' HG23 ' A' ' 727' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.873 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 619' ' ' TRP . . . . . 0.456 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.736 0.303 . . . . 0.0 110.779 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . -66.3 169.48 32.35 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.452 -0.88 . . . . 0.0 111.907 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -64.15 -29.04 64.98 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.365 2.044 . . . . 0.0 111.862 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 46.4 m-80 -63.94 -38.61 91.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.932 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 623' ' ' VAL . . . . . 0.442 ' HB ' ' CG ' ' A' ' 619' ' ' TRP . 41.4 t -73.3 -36.65 49.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.116 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 624' ' ' GLN . . . . . 0.442 ' CG ' HD11 ' A' ' 722' ' ' LEU . 1.1 tm0? -59.41 -48.09 82.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.839 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.49 -49.41 66.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.024 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 9.6 tt -62.32 -31.19 71.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.063 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 627' ' ' ALA . . . . . 0.562 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -66.79 -52.16 47.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.3 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 1.3 m -57.14 -53.19 60.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.124 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 629' ' ' ILE . . . . . 0.678 HG21 HD23 ' A' ' 653' ' ' LEU . 18.8 mt -58.92 -39.84 78.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.054 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 4.1 tmmm? -59.81 -40.48 88.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.837 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 631' ' ' LYS . . . . . 0.452 ' HD3' HD22 ' A' ' 717' ' ' LEU . 4.8 tttm -66.08 -40.76 91.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.001 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 632' ' ' HIS . . . . . 0.749 ' CE1' HD11 ' A' ' 709' ' ' LEU . 67.3 t60 -68.34 -44.95 74.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.031 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.469 HD21 ' CD2' ' A' ' 702' ' ' TYR . 25.6 mt -56.53 -49.82 73.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.26 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 18.4 ptt180 -61.87 -41.72 98.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.841 0.353 . . . . 0.0 110.913 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.63 -19.49 60.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.25 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 34.4 tp60 -89.1 -8.55 53.62 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.646 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 113.3 3.92 24.0 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.39 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 638' ' ' ILE . . . . . 0.429 HG21 ' CE2' ' A' ' 702' ' ' TYR . 17.2 mt -111.5 104.83 17.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-O 120.747 0.308 . . . . 0.0 111.267 -179.44 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -82.59 110.78 17.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.868 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 640' ' ' MET . . . . . 0.428 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.8 ttp -121.11 30.73 6.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.966 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.32 -29.81 71.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.873 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 642' ' ' GLU . . . . . 0.556 ' O ' HD12 ' A' ' 643' ' ' LEU . 12.0 mt-10 -71.57 -76.18 0.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.019 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 643' ' ' LEU . . . . . 0.556 HD12 ' O ' ' A' ' 642' ' ' GLU . 0.1 OUTLIER -179.75 139.24 0.32 Allowed Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.846 -179.99 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_endo -77.95 138.52 16.6 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.603 2.202 . . . . 0.0 112.455 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 645' ' ' LEU . . . . . 0.659 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.8 tp -134.9 151.21 50.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.229 0.538 . . . . 0.0 111.121 179.737 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 646' ' ' ILE . . . . . 0.632 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.2 tt -148.96 132.55 7.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.386 -0.824 . . . . 0.0 109.533 178.998 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 52.26 43.18 56.97 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.3 -0.952 . . . . 0.0 112.21 -179.274 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 68.71 6.61 51.49 Favored Glycine 0 C--N 1.334 0.453 0 C-N-CA 121.032 -0.604 . . . . 0.0 113.91 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 87.0 m -131.51 163.07 28.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 117.507 0.654 . . . . 0.0 111.513 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 650' ' ' GLU . . . . . 0.659 ' HA ' HD12 ' A' ' 645' ' ' LEU . 2.7 mt-10 -80.5 143.88 32.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.798 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 651' ' ' LEU . . . . . 0.614 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -135.0 144.93 47.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.344 -179.841 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -94.02 107.99 19.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.971 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 653' ' ' LEU . . . . . 0.678 HD23 HG21 ' A' ' 629' ' ' ILE . 7.2 mp -54.32 -42.89 70.67 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.997 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -61.44 -46.68 89.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.013 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 1.1 t -66.79 -35.6 80.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.743 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 656' ' ' PHE . . . . . 0.425 ' CZ ' ' HG ' ' A' ' 682' ' ' LEU . 0.2 OUTLIER -70.68 -42.46 70.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.887 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -59.78 -52.04 67.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.039 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 16.9 ttt180 -59.97 -43.41 95.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.093 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 659' ' ' LEU . . . . . 0.477 HD13 HD21 ' A' ' 682' ' ' LEU . 0.1 OUTLIER -56.84 -43.32 80.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.024 -179.845 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 660' ' ' ILE . . . . . 0.718 HG23 HG21 ' A' ' 669' ' ' VAL . 89.4 mt -64.26 -43.61 97.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.736 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -64.17 -45.89 86.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.052 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -61.23 -21.0 63.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.178 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.81 8.77 21.4 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.503 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 98.87 25.64 9.59 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.638 -0.792 . . . . 0.0 112.644 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 92.0 174.8 42.48 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.561 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 666' ' ' MET . . . . . 0.683 ' HG2' HG21 ' A' ' 660' ' ' ILE . 0.0 OUTLIER -69.66 -25.69 64.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.661 0.267 . . . . 0.0 111.09 179.863 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 667' ' ' GLN . . . . . 0.404 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 15.9 pt20 -59.1 -48.51 81.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.797 -179.358 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 668' ' ' GLN . . . . . 0.442 ' HG3' HD22 ' A' ' 672' ' ' LEU . 0.0 OUTLIER -64.82 -52.81 54.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.897 0.379 . . . . 0.0 111.225 -179.483 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 669' ' ' VAL . . . . . 0.718 HG21 HG23 ' A' ' 660' ' ' ILE . 57.5 t -49.54 -55.35 4.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.681 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 670' ' ' THR . . . . . 0.659 HG22 ' O ' ' A' ' 666' ' ' MET . 10.6 t -76.44 -48.53 19.38 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 -178.176 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 671' ' ' ASP . . . . . 0.456 ' N ' HG23 ' A' ' 670' ' ' THR . 5.0 t70 -66.31 -51.08 60.93 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -177.649 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 672' ' ' LEU . . . . . 0.442 HD22 ' HG3' ' A' ' 668' ' ' GLN . 11.1 mp -77.52 3.83 12.6 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -179.046 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 48.92 84.18 0.03 OUTLIER 'General case' 0 C--O 1.231 0.125 0 CA-C-O 120.936 0.398 . . . . 0.0 110.446 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 62.1 tttt -145.65 22.16 1.46 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.327 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 675' ' ' TRP . . . . . 1.109 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 34.9 m95 -61.13 -28.91 69.45 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 121.381 0.61 . . . . 0.0 110.125 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -56.02 -43.43 77.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.546 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.41 -51.61 11.5 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 120.687 0.28 . . . . 0.0 111.538 -179.279 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.979 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.01 -41.21 71.0 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 179.738 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 679' ' ' ALA . . . . . 0.827 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.55 -34.66 70.19 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.743 179.346 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -53.23 -48.54 68.08 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.452 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 3.9 ttm -63.81 -21.56 66.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.702 179.361 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 682' ' ' LEU . . . . . 0.477 HD21 HD13 ' A' ' 659' ' ' LEU . 2.2 mm? -80.48 -1.87 43.49 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.402 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 683' ' ' ARG . . . . . 0.752 ' C ' HD12 ' A' ' 684' ' ' ILE . 0.3 OUTLIER 71.23 71.74 0.18 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.887 0.375 . . . . 0.0 111.293 179.95 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 684' ' ' ILE . . . . . 0.752 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.7 mp -120.57 137.16 25.93 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.626 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 685' ' ' PRO . . . . . 0.427 ' HD2' HG23 ' A' ' 684' ' ' ILE . 41.8 Cg_endo -67.51 123.91 11.38 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.47 2.113 . . . . 0.0 112.328 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 686' ' ' LYS . . . . . 0.428 ' HE3' HG23 ' A' ' 687' ' ' THR . 0.7 OUTLIER -69.94 -13.7 62.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.412 -179.968 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 687' ' ' THR . . . . . 0.428 HG23 ' HE3' ' A' ' 686' ' ' LYS . 1.5 p -65.34 -22.28 66.8 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.748 0.309 . . . . 0.0 111.253 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 688' ' ' ALA . . . . . 0.453 ' CB ' ' HB2' ' A' ' 691' ' ' ARG . . . -88.46 100.16 12.83 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.889 0.376 . . . . 0.0 110.937 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 13.1 mp0 -68.53 -67.56 0.46 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.289 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -52.81 -19.26 2.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.872 -179.549 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 691' ' ' ARG . . . . . 0.658 HH22 HD22 ' A' ' 695' ' ' LEU . 0.0 OUTLIER -45.39 -42.04 9.76 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.783 0.325 . . . . 0.0 111.347 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 692' ' ' LEU . . . . . 0.428 HD13 ' HA ' ' A' ' 692' ' ' LEU . 3.6 mm? -56.58 -42.69 79.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.955 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.99 -37.18 69.9 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.79 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 1.3 ttpp -64.62 -40.23 95.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.241 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 1.109 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.4 OUTLIER -65.13 -44.08 89.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.254 179.517 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.461 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 2.0 mt-30 -55.48 -45.96 76.94 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.798 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -77.16 -29.66 54.59 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.073 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 698' ' ' ALA . . . . . 0.412 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.63 -39.03 84.66 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.599 -179.796 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 699' ' ' TYR . . . . . 0.461 ' CE2' ' HA ' ' A' ' 696' ' ' GLN . 1.3 p90 -84.72 -32.78 23.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.88 0.371 . . . . 0.0 110.488 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 700' ' ' CYS . . . . . 0.472 ' HA ' HD23 ' A' ' 704' ' ' LEU . 32.6 t -66.03 -30.62 71.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.721 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -97.65 -2.07 42.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.329 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 702' ' ' TYR . . . . . 0.469 ' CD2' HD21 ' A' ' 633' ' ' LEU . 6.8 m-85 -121.61 -74.83 0.6 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.869 0.366 . . . . 0.0 111.245 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 703' ' ' LEU . . . . . 0.471 ' CD2' HD12 ' A' ' 660' ' ' ILE . 1.7 tp -58.37 -48.4 80.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.589 -179.374 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.472 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.6 OUTLIER -50.17 -47.62 54.38 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.861 0.362 . . . . 0.0 111.481 -179.663 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.66 -55.19 32.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.128 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 706' ' ' TYR . . . . . 0.513 ' CD1' HD12 ' A' ' 709' ' ' LEU . 57.9 t80 -66.78 -29.7 69.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.276 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -76.29 -18.82 58.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.43 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 36.6 p -95.87 -14.65 23.0 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.703 0.287 . . . . 0.0 111.437 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 709' ' ' LEU . . . . . 0.749 HD11 ' CE1' ' A' ' 632' ' ' HIS . 70.2 mt -56.46 151.12 13.83 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.939 0.4 . . . . 0.0 111.358 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 710' ' ' SER . . . . . 0.418 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.6 OUTLIER -78.76 169.73 19.38 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.603 179.66 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 711' ' ' PRO . . . . . 0.418 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 55.7 Cg_endo -70.06 -12.83 33.07 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.519 2.146 . . . . 0.0 112.851 -179.765 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -75.47 -56.78 4.37 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.847 0.356 . . . . 0.0 111.109 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 713' ' ' GLU . . . . . 0.699 ' CD ' HD22 ' A' ' 709' ' ' LEU . 0.0 OUTLIER -68.93 -25.41 64.56 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.689 179.939 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 714' ' ' HIS . . . . . 0.406 ' CE1' ' CE2' ' A' ' 706' ' ' TYR . 0.4 OUTLIER -70.03 -54.79 11.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.298 -0.41 . . . . 0.0 109.921 179.361 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 2.2 tpt180 -60.65 -40.31 91.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.056 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 27.6 ttp180 -65.33 -53.78 38.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.091 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 717' ' ' LEU . . . . . 0.591 HD12 ' HG3' ' A' ' 713' ' ' GLU . 47.1 mt -60.45 -41.48 94.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.795 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 718' ' ' GLU . . . . . 0.729 ' HG3' HD13 ' A' ' 722' ' ' LEU . 41.7 tt0 -66.99 -54.15 24.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.441 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.8 -31.6 27.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.482 -179.754 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 720' ' ' GLU . . . . . 0.425 ' O ' ' HG2' ' A' ' 723' ' ' MET . 18.4 mm-40 -72.06 -55.39 7.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.006 0.431 . . . . 0.0 110.514 179.798 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 721' ' ' VAL . . . . . 0.562 HG11 ' HB1' ' A' ' 627' ' ' ALA . 40.2 t -62.6 -54.6 31.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.757 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 722' ' ' LEU . . . . . 0.729 HD13 ' HG3' ' A' ' 718' ' ' GLU . 7.0 mp -53.6 -40.81 66.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.852 -179.389 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 723' ' ' MET . . . . . 0.722 ' O ' HD12 ' A' ' 727' ' ' ILE . 8.2 ptp -71.34 -39.15 71.52 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.024 179.551 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 724' ' ' GLU . . . . . 0.426 ' N ' ' HG3' ' A' ' 723' ' ' MET . 6.6 mm-40 -57.92 -31.32 66.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.119 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 725' ' ' LYS . . . . . 0.448 ' HD3' ' NE1' ' A' ' 619' ' ' TRP . 11.4 pttt -86.12 -34.45 20.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.443 -179.685 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 726' ' ' GLU . . . . . 0.409 ' N ' ' HG3' ' A' ' 725' ' ' LYS . 3.5 mm-40 -73.5 -47.55 40.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.282 -179.529 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 727' ' ' ILE . . . . . 0.722 HD12 ' O ' ' A' ' 723' ' ' MET . 4.0 mp -88.16 11.6 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.635 -179.789 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 3.2 tt -64.41 -35.75 81.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.817 0.341 . . . . 0.0 110.837 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -58.64 -43.6 89.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.985 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 1.7 mtmt . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.858 -179.992 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 619' ' ' TRP . . . . . 0.454 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.135 0 CA-C-O 120.598 0.237 . . . . 0.0 111.387 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 124.29 165.08 12.12 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.363 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -70.6 -41.93 2.88 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.596 2.197 . . . . 0.0 112.461 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 622' ' ' ASN . . . . . 0.413 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 7.1 p30 -66.75 -30.93 71.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.01 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 623' ' ' VAL . . . . . 0.454 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 55.5 t -74.96 -40.8 45.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.917 0.389 . . . . 0.0 110.442 179.391 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 35.7 tp60 -65.09 -34.59 78.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.951 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 81.6 mtm-85 -64.7 -50.72 65.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.248 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 626' ' ' LEU . . . . . 0.825 HD13 ' O ' ' A' ' 626' ' ' LEU . 2.0 tm? -62.02 -32.14 72.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.691 179.592 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -74.04 -53.92 8.96 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.744 -179.666 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 25.0 p -57.07 -42.38 80.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.24 -179.509 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 629' ' ' ILE . . . . . 0.595 HG22 ' CD1' ' A' ' 633' ' ' LEU . 55.4 mt -68.68 -40.48 81.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.882 0.373 . . . . 0.0 110.732 179.718 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 2.5 ttpt -62.0 -46.57 88.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.718 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 5.3 tttm -65.18 -40.52 94.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.088 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 632' ' ' HIS . . . . . 0.586 ' CE1' ' HG3' ' A' ' 636' ' ' GLN . 26.9 t-80 -68.85 -44.85 72.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.084 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.613 HD13 ' SD ' ' A' ' 640' ' ' MET . 35.6 mt -56.21 -49.91 72.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.308 -179.623 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -62.73 -42.29 99.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.997 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.74 -16.1 61.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.299 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 636' ' ' GLN . . . . . 0.586 ' HG3' ' CE1' ' A' ' 632' ' ' HIS . 67.8 mm-40 -92.67 -9.12 42.0 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.563 -179.758 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 114.41 0.33 23.52 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.374 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 638' ' ' ILE . . . . . 0.555 HD11 ' OE1' ' A' ' 701' ' ' GLN . 11.4 mt -108.16 105.41 18.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 CA-C-O 120.767 0.318 . . . . 0.0 111.254 -179.531 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.29 109.82 17.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.851 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 640' ' ' MET . . . . . 0.613 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.7 mtp -118.16 28.71 8.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.961 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.88 -38.15 90.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.903 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -60.96 -76.4 0.05 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.997 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 643' ' ' LEU . . . . . 0.543 HD13 ' HD2' ' A' ' 644' ' ' PRO . 0.2 OUTLIER -178.74 123.28 0.24 Allowed Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.761 179.949 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 644' ' ' PRO . . . . . 0.543 ' HD2' HD13 ' A' ' 643' ' ' LEU . 29.6 Cg_endo -63.26 139.95 74.73 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.488 2.125 . . . . 0.0 112.33 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 645' ' ' LEU . . . . . 0.659 HD12 ' HA ' ' A' ' 650' ' ' GLU . 5.0 tp -142.01 153.2 44.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.269 0.557 . . . . 0.0 111.223 179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 646' ' ' ILE . . . . . 0.51 HD11 ' HA ' ' A' ' 695' ' ' LEU . 3.2 tt -149.84 133.76 8.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.466 178.916 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 49.72 43.43 37.99 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.192 -1.004 . . . . 0.0 111.98 -179.226 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 68.48 6.02 46.7 Favored Glycine 0 CA--C 1.521 0.427 0 C-N-CA 121.149 -0.548 . . . . 0.0 113.972 179.409 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.3 m -129.58 160.89 31.87 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 117.586 0.693 . . . . 0.0 111.697 -178.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 650' ' ' GLU . . . . . 0.659 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.9 OUTLIER -78.9 140.62 38.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.824 179.856 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 651' ' ' LEU . . . . . 0.632 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.63 144.92 48.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.14 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -96.86 111.65 23.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.866 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 653' ' ' LEU . . . . . 0.4 ' HB2' ' CD2' ' A' ' 626' ' ' LEU . 3.4 mm? -54.62 -37.77 66.01 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.89 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 654' ' ' ALA . . . . . 0.413 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -63.91 -46.0 86.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.893 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 33.8 t -66.71 -35.43 80.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.646 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 656' ' ' PHE . . . . . 0.405 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.3 OUTLIER -70.53 -44.58 67.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.783 179.852 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 36.2 t80 -58.01 -43.26 86.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.73 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -66.1 -43.59 86.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.692 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 659' ' ' LEU . . . . . 0.675 HD21 ' HE2' ' A' ' 681' ' ' MET . 0.1 OUTLIER -56.68 -52.39 65.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.215 -179.844 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 660' ' ' ILE . . . . . 0.721 HG23 HG21 ' A' ' 669' ' ' VAL . 57.1 mt -57.87 -45.19 87.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.049 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -64.61 -44.27 91.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.396 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -55.13 -22.9 18.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.412 -179.51 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 12.6 mtm -95.49 35.91 1.3 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.853 0.358 . . . . 0.0 110.845 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 88.23 -50.8 3.91 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.354 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 665' ' ' GLY . . . . . 0.413 ' O ' HG23 ' A' ' 669' ' ' VAL . . . 171.76 -174.73 45.23 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 121.025 -0.607 . . . . 0.0 111.914 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 666' ' ' MET . . . . . 0.587 ' O ' HG22 ' A' ' 670' ' ' THR . 11.1 tpt -73.08 -30.35 63.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.872 0.368 . . . . 0.0 110.899 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -57.65 -49.1 77.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.412 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 668' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.66 -52.7 62.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.858 0.361 . . . . 0.0 111.294 -179.751 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 669' ' ' VAL . . . . . 0.721 HG21 HG23 ' A' ' 660' ' ' ILE . 56.4 t -49.31 -55.41 4.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.792 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 670' ' ' THR . . . . . 0.587 HG22 ' O ' ' A' ' 666' ' ' MET . 14.1 t -76.09 -49.64 16.87 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -178.284 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 671' ' ' ASP . . . . . 0.465 ' N ' HG23 ' A' ' 670' ' ' THR . 63.8 m-20 -61.97 -51.07 69.57 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 -177.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 9.1 mp -78.93 5.2 12.14 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 48.87 83.63 0.04 OUTLIER 'General case' 0 C--O 1.231 0.122 0 CA-C-O 120.994 0.426 . . . . 0.0 110.535 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 14.8 mttm -142.46 22.98 2.0 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.188 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 675' ' ' TRP . . . . . 1.111 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 37.7 m95 -61.44 -27.62 68.69 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.358 0.599 . . . . 0.0 110.221 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 -57.3 -45.57 84.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.613 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.45 -51.63 12.58 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 120.703 0.287 . . . . 0.0 111.587 -179.355 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.975 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -54.9 -40.64 70.02 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 179.759 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 679' ' ' ALA . . . . . 0.849 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.78 -33.9 68.99 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.602 179.312 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.22 -50.37 64.88 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.417 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 681' ' ' MET . . . . . 0.675 ' HE2' HD21 ' A' ' 659' ' ' LEU . 2.8 mtp -62.11 -19.88 63.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.78 179.301 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 682' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -84.71 -1.5 56.27 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.384 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 683' ' ' ARG . . . . . 0.758 ' C ' HD12 ' A' ' 684' ' ' ILE . 23.3 mmm-85 70.86 71.69 0.19 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.946 0.403 . . . . 0.0 111.029 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 684' ' ' ILE . . . . . 0.758 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.6 mp -121.1 137.47 26.71 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.654 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 685' ' ' PRO . . . . . 0.418 ' HD2' HG23 ' A' ' 684' ' ' ILE . 38.9 Cg_endo -67.09 121.84 9.06 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.391 2.06 . . . . 0.0 112.381 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.91 -18.95 63.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.269 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -65.37 -22.15 66.77 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.241 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 688' ' ' ALA . . . . . 0.432 ' HB1' ' HG3' ' A' ' 691' ' ' ARG . . . -84.53 105.23 15.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.977 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 20.0 mp0 -70.12 -68.61 0.41 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.164 -179.676 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -51.73 -20.69 2.25 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.798 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 691' ' ' ARG . . . . . 0.438 ' CZ ' HG13 ' A' ' 684' ' ' ILE . 0.0 OUTLIER -47.98 -36.4 12.59 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.865 0.364 . . . . 0.0 111.121 179.873 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -65.38 -45.72 82.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.898 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.02 -37.9 69.69 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.855 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.92 -39.64 94.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.08 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 1.111 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.2 OUTLIER -65.95 -42.15 90.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.135 179.408 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.432 ' O ' ' CD1' ' A' ' 699' ' ' TYR . 23.5 mt-30 -57.48 -44.09 84.6 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.786 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -77.31 -30.0 53.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.157 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 698' ' ' ALA . . . . . 0.424 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -66.6 -37.75 85.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.442 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 699' ' ' TYR . . . . . 0.554 ' CE2' ' HE2' ' A' ' 666' ' ' MET . 1.8 p90 -86.54 -34.91 19.81 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.108 0.48 . . . . 0.0 109.961 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 700' ' ' CYS . . . . . 0.453 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 52.4 t -61.01 -30.59 70.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.617 179.779 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 701' ' ' GLN . . . . . 0.555 ' OE1' HD11 ' A' ' 638' ' ' ILE . 0.3 OUTLIER -99.75 -3.4 32.91 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.351 179.921 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 702' ' ' TYR . . . . . 0.496 ' CZ ' HG21 ' A' ' 638' ' ' ILE . 4.8 m-85 -115.47 -77.16 0.57 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.882 0.372 . . . . 0.0 111.366 -179.634 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 703' ' ' LEU . . . . . 0.411 ' CD2' HD12 ' A' ' 660' ' ' ILE . 1.9 tp -63.6 -40.63 97.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.662 -179.266 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.545 HD23 ' CE2' ' A' ' 699' ' ' TYR . 0.5 OUTLIER -54.06 -50.63 66.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.902 0.382 . . . . 0.0 111.207 -179.68 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -54.3 -54.6 38.08 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.897 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 706' ' ' TYR . . . . . 0.565 ' O ' HD22 ' A' ' 709' ' ' LEU . 20.4 t80 -57.78 -28.87 64.38 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.415 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -96.99 -1.82 44.79 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.49 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -106.82 -20.82 13.22 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.584 0.23 . . . . 0.0 111.602 -179.436 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 709' ' ' LEU . . . . . 0.565 HD22 ' O ' ' A' ' 706' ' ' TYR . 0.2 OUTLIER -77.54 176.15 9.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.799 0.333 . . . . 0.0 110.97 -179.846 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.16 164.98 57.38 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.158 -179.699 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -66.68 -28.93 43.85 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.653 2.235 . . . . 0.0 112.102 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -48.86 -48.75 41.71 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.702 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 713' ' ' GLU . . . . . 0.516 ' HB2' HD11 ' A' ' 709' ' ' LEU . 3.5 mm-40 -61.34 -26.38 67.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.059 179.713 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -76.04 -54.28 7.09 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.989 0.423 . . . . 0.0 110.322 179.419 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.31 -43.27 96.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.336 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.61 -53.96 34.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.824 0.345 . . . . 0.0 111.168 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 717' ' ' LEU . . . . . 0.451 ' O ' HG23 ' A' ' 721' ' ' VAL . 76.2 mt -62.25 -42.12 99.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.092 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -68.84 -54.21 17.01 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.47 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 6.4 mmtt -50.81 -31.85 18.26 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.106 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 720' ' ' GLU . . . . . 0.428 ' O ' ' HG2' ' A' ' 723' ' ' MET . 13.1 mt-10 -70.96 -55.5 8.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.497 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 721' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 717' ' ' LEU . 35.4 t -63.2 -54.84 27.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.872 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -52.9 -41.11 64.08 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.942 -179.263 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 723' ' ' MET . . . . . 0.583 ' HB2' HD13 ' A' ' 727' ' ' ILE . 15.4 ptp -73.92 -40.72 62.91 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.066 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -54.54 -40.73 68.95 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.312 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 725' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.13 -37.56 18.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.289 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.65 -57.28 8.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.875 0.369 . . . . 0.0 111.029 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 727' ' ' ILE . . . . . 0.632 ' O ' HG22 ' A' ' 727' ' ' ILE . 4.1 mp -88.19 11.64 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.676 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 728' ' ' LEU . . . . . 0.484 ' O ' HD23 ' A' ' 728' ' ' LEU . 1.8 tt -52.22 -41.63 62.89 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.827 0.346 . . . . 0.0 111.159 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -76.4 -59.91 2.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.934 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 13.2 mtmt . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.236 -0.888 . . . . 0.0 110.891 -179.966 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 619' ' ' TRP . . . . . 0.491 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.123 0 CA-C-O 120.643 0.259 . . . . 0.0 111.248 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 124.41 165.24 12.14 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.484 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -68.0 -35.38 20.5 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 122.575 2.184 . . . . 0.0 112.222 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 622' ' ' ASN . . . . . 0.577 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 11.0 p30 -66.65 -39.36 88.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.852 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 623' ' ' VAL . . . . . 0.453 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 41.2 t -72.95 -40.84 60.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.77 179.613 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 624' ' ' GLN . . . . . 0.688 ' CG ' HD11 ' A' ' 722' ' ' LEU . 1.1 tm0? -58.0 -41.42 83.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.641 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 625' ' ' ARG . . . . . 0.414 ' O ' HD12 ' A' ' 629' ' ' ILE . 0.0 OUTLIER -68.03 -47.7 67.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.67 179.85 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 626' ' ' LEU . . . . . 0.629 HD23 ' O ' ' A' ' 626' ' ' LEU . 5.6 tt -62.22 -32.92 73.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.004 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -73.92 -50.01 22.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.273 -179.801 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.08 -47.14 81.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.056 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 629' ' ' ILE . . . . . 0.619 HG21 HD23 ' A' ' 653' ' ' LEU . 12.1 mt -65.42 -41.22 90.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.046 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 9.4 ttpt -61.7 -50.98 70.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.797 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 7.2 tttm -56.58 -41.0 76.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.168 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 632' ' ' HIS . . . . . 0.686 ' HB2' HD13 ' A' ' 717' ' ' LEU . 80.7 t60 -70.97 -43.29 68.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.309 -179.757 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.482 HD13 ' SD ' ' A' ' 640' ' ' MET . 48.1 mt -56.28 -48.01 77.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.166 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 634' ' ' ARG . . . . . 0.402 ' HG3' ' N ' ' A' ' 635' ' ' SER . 38.3 ptt180 -66.04 -41.07 91.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.813 0.34 . . . . 0.0 110.626 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 635' ' ' SER . . . . . 0.402 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 0.1 OUTLIER -73.76 -11.56 60.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.184 179.638 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -98.74 -7.73 27.2 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.605 -0.271 . . . . 0.0 111.659 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 115.52 -0.01 21.89 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.508 -0.853 . . . . 0.0 112.542 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 638' ' ' ILE . . . . . . . . . . . . . 14.5 mt -109.4 104.71 17.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.662 0.268 . . . . 0.0 111.223 -179.474 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.92 113.55 15.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.829 0.347 . . . . 0.0 110.964 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 640' ' ' MET . . . . . 0.482 ' SD ' HD13 ' A' ' 633' ' ' LEU . 2.0 ttp -123.73 31.49 5.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.859 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.7 -33.72 71.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.934 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 642' ' ' GLU . . . . . 0.612 ' HB3' HD23 ' A' ' 643' ' ' LEU . 18.4 mt-10 -70.28 -78.33 0.07 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.893 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 643' ' ' LEU . . . . . 0.612 HD23 ' HB3' ' A' ' 642' ' ' GLU . 2.0 pt? -177.59 132.53 0.34 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.877 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 644' ' ' PRO . . . . . 0.41 ' HB2' HD11 ' A' ' 651' ' ' LEU . 95.4 Cg_endo -79.67 135.3 11.47 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.531 2.154 . . . . 0.0 112.284 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 645' ' ' LEU . . . . . 0.586 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.6 tp -129.09 152.42 48.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.237 0.542 . . . . 0.0 111.216 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 646' ' ' ILE . . . . . 0.672 HD11 ' HA ' ' A' ' 695' ' ' LEU . 4.2 tt -149.74 133.95 8.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.921 179.204 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.41 38.85 58.38 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.362 -0.923 . . . . 0.0 112.198 -179.491 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.14 8.01 64.18 Favored Glycine 0 C--N 1.332 0.335 0 C-N-CA 120.981 -0.628 . . . . 0.0 113.71 179.364 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.3 m -134.38 164.18 28.01 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 117.341 0.571 . . . . 0.0 111.43 -179.365 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 650' ' ' GLU . . . . . 0.586 ' HA ' HD12 ' A' ' 645' ' ' LEU . 13.2 mt-10 -79.98 146.0 32.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.833 179.858 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 651' ' ' LEU . . . . . 0.612 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.54 144.93 48.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.381 -179.824 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -96.91 109.8 22.44 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.859 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 653' ' ' LEU . . . . . 0.619 HD23 HG21 ' A' ' 629' ' ' ILE . 6.8 mp -54.17 -35.96 62.86 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.284 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 654' ' ' ALA . . . . . 0.577 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -65.59 -43.47 89.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.109 -179.895 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -73.01 -34.73 66.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.61 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 656' ' ' PHE . . . . . 0.451 ' CZ ' ' HG ' ' A' ' 682' ' ' LEU . 0.2 OUTLIER -70.92 -47.98 56.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.801 179.866 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -58.71 -52.81 64.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.098 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 2.6 ptm85 -59.1 -40.14 84.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.853 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 659' ' ' LEU . . . . . 0.522 HD23 HD12 ' A' ' 678' ' ' LEU . 0.6 OUTLIER -60.47 -48.78 80.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.332 -179.704 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 660' ' ' ILE . . . . . 0.628 HG23 HG21 ' A' ' 669' ' ' VAL . 29.2 mt -56.71 -45.22 82.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-O 120.834 0.349 . . . . 0.0 110.561 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -63.96 -39.79 94.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.915 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -74.48 -13.9 60.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.486 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -94.24 36.63 1.13 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.716 0.294 . . . . 0.0 111.164 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 73.64 31.57 60.44 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.365 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 665' ' ' GLY . . . . . 0.513 ' O ' HG23 ' A' ' 669' ' ' VAL . . . 82.47 173.15 48.83 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.365 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 666' ' ' MET . . . . . 0.49 ' HE1' ' HB ' ' A' ' 669' ' ' VAL . 0.0 OUTLIER -71.17 -40.55 71.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.738 0.304 . . . . 0.0 111.062 179.985 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -52.57 -43.77 65.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.453 -179.597 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 668' ' ' GLN . . . . . 0.416 ' HG3' HD11 ' A' ' 672' ' ' LEU . 0.4 OUTLIER -64.81 -40.86 95.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.935 0.398 . . . . 0.0 110.832 179.937 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 669' ' ' VAL . . . . . 0.628 HG21 HG23 ' A' ' 660' ' ' ILE . 58.7 t -57.88 -55.82 19.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.434 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 670' ' ' THR . . . . . 0.497 HG23 ' N ' ' A' ' 671' ' ' ASP . 8.8 t -75.98 -53.88 7.71 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -178.862 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 671' ' ' ASP . . . . . 0.497 ' N ' HG23 ' A' ' 670' ' ' THR . 19.2 t0 -54.21 -50.97 65.88 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -178.561 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 672' ' ' LEU . . . . . 0.416 HD11 ' HG3' ' A' ' 668' ' ' GLN . 25.0 mt -77.77 -1.75 32.95 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 -179.171 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 24.4 mttt 49.46 82.7 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 121.09 0.471 . . . . 0.0 110.433 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 40.0 mttt -146.31 22.47 1.34 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.926 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 675' ' ' TRP . . . . . 1.106 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 31.9 m95 -57.24 -31.02 65.11 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 121.445 0.64 . . . . 0.0 110.073 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -56.84 -40.79 76.72 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.411 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.52 -51.62 10.42 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 120.776 0.322 . . . . 0.0 111.409 -179.545 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.987 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -57.48 -37.4 72.86 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.591 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 679' ' ' ALA . . . . . 0.875 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.48 -37.54 71.29 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.429 179.284 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -53.09 -46.29 68.57 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.314 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 35.0 mtp -65.24 -24.51 67.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.564 179.227 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 682' ' ' LEU . . . . . 0.454 HD23 ' O ' ' A' ' 678' ' ' LEU . 3.3 mm? -78.15 -2.07 35.73 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.535 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 683' ' ' ARG . . . . . 0.667 ' C ' HD12 ' A' ' 684' ' ' ILE . 1.6 mpp_? 68.68 71.79 0.28 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.883 0.373 . . . . 0.0 111.401 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 684' ' ' ILE . . . . . 0.667 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.9 mp -124.25 137.53 29.26 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.352 179.525 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 685' ' ' PRO . . . . . 0.402 ' HD2' HG23 ' A' ' 684' ' ' ILE . 24.8 Cg_endo -62.04 116.08 3.24 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.332 2.022 . . . . 0.0 112.298 -179.821 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -20.19 66.33 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.95 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 12.7 p -67.65 -23.87 65.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.204 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 688' ' ' ALA . . . . . 0.611 ' HB3' ' HG2' ' A' ' 691' ' ' ARG . . . -64.64 111.02 2.55 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.986 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 19.9 mm-40 -83.06 4.85 24.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.559 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -121.78 -16.64 7.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.65 179.243 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 691' ' ' ARG . . . . . 0.818 ' HG3' HD22 ' A' ' 692' ' ' LEU . 2.3 ppt_? -52.66 -32.07 40.37 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.473 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 692' ' ' LEU . . . . . 0.818 HD22 ' HG3' ' A' ' 691' ' ' ARG . 2.7 mm? -70.51 -54.54 11.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.729 0.299 . . . . 0.0 111.488 -179.785 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.78 -39.03 70.19 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.406 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 694' ' ' LYS . . . . . 0.406 ' O ' ' HB2' ' A' ' 698' ' ' ALA . 0.7 OUTLIER -63.55 -37.36 87.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.979 0.419 . . . . 0.0 109.98 179.442 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 1.106 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 3.9 tp -65.54 -47.76 74.77 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.854 179.736 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.432 ' HA ' ' CD2' ' A' ' 699' ' ' TYR . 14.7 tt0 -55.19 -47.8 74.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.254 -179.621 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -77.2 -29.81 54.46 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.247 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 698' ' ' ALA . . . . . 0.417 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.78 -37.06 81.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.754 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 699' ' ' TYR . . . . . 0.482 ' CZ ' ' HE3' ' A' ' 666' ' ' MET . 1.4 p90 -86.28 -34.95 20.21 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.008 0.432 . . . . 0.0 110.361 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 700' ' ' CYS . . . . . 0.412 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 1.7 m -64.23 -30.57 71.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.784 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 25.0 tt0 -97.3 -3.44 40.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.451 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 702' ' ' TYR . . . . . 0.417 ' CD1' ' O ' ' A' ' 698' ' ' ALA . 5.6 m-85 -117.42 -78.59 0.58 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.824 0.345 . . . . 0.0 111.315 -179.716 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 703' ' ' LEU . . . . . 0.544 HD13 HD12 ' A' ' 660' ' ' ILE . 77.9 mt -58.29 -45.78 87.32 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.532 -179.535 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.471 HD23 ' CE1' ' A' ' 699' ' ' TYR . 1.1 mm? -55.25 -49.05 73.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.919 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 705' ' ' SER . . . . . 0.64 ' O ' HD13 ' A' ' 709' ' ' LEU . 2.2 m -54.68 -55.68 27.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.299 179.675 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 706' ' ' TYR . . . . . 0.442 ' O ' HD21 ' A' ' 709' ' ' LEU . 14.3 t80 -47.44 -38.63 13.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.689 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -96.89 0.28 48.84 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -81.35 -19.71 42.19 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 709' ' ' LEU . . . . . 0.64 HD13 ' O ' ' A' ' 705' ' ' SER . 0.0 OUTLIER -92.27 -176.64 4.41 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.002 0.43 . . . . 0.0 111.458 -179.599 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 710' ' ' SER . . . . . 0.445 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.6 OUTLIER -84.7 168.59 20.19 Favored Pre-proline 0 C--N 1.331 -0.208 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.997 -179.804 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 711' ' ' PRO . . . . . 0.445 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 19.0 Cg_endo -59.01 -19.37 47.98 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.596 2.198 . . . . 0.0 112.569 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -59.36 -52.41 65.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.764 0.316 . . . . 0.0 110.73 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 713' ' ' GLU . . . . . 0.447 ' HB2' ' HG ' ' A' ' 709' ' ' LEU . 4.8 mm-40 -64.19 -25.69 68.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.842 179.56 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -74.42 -54.7 7.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.094 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.19 -34.78 79.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.394 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.08 -53.97 25.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.75 0.309 . . . . 0.0 111.045 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 717' ' ' LEU . . . . . 0.686 HD13 ' HB2' ' A' ' 632' ' ' HIS . 43.8 mt -65.4 -36.73 84.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.055 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 718' ' ' GLU . . . . . 0.581 ' HG2' HD22 ' A' ' 722' ' ' LEU . 37.2 tt0 -71.7 -54.22 11.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.482 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 2.5 mmtm -54.55 -30.91 55.39 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.207 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 720' ' ' GLU . . . . . 0.447 ' O ' ' HG2' ' A' ' 723' ' ' MET . 3.4 mm-40 -71.56 -55.8 7.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.991 0.424 . . . . 0.0 110.508 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 721' ' ' VAL . . . . . 0.539 HG23 ' O ' ' A' ' 717' ' ' LEU . 42.3 t -62.8 -50.75 78.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.915 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 722' ' ' LEU . . . . . 0.688 HD11 ' CG ' ' A' ' 624' ' ' GLN . 9.4 mp -56.93 -37.97 72.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.89 -179.24 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 723' ' ' MET . . . . . 0.551 ' O ' HD12 ' A' ' 727' ' ' ILE . 13.7 ptp -74.16 -39.13 63.46 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.26 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 724' ' ' GLU . . . . . 0.427 ' N ' ' HG3' ' A' ' 723' ' ' MET . 3.8 mt-10 -60.52 -31.0 70.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.057 -179.783 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 725' ' ' LYS . . . . . 0.417 ' HD2' ' CE2' ' A' ' 619' ' ' TRP . 9.5 pttt -86.09 -41.04 15.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.304 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -69.97 -50.6 40.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.155 -179.673 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 727' ' ' ILE . . . . . 0.784 HG23 ' HE3' ' A' ' 730' ' ' LYS . 4.2 mp -88.13 11.61 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.631 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 2.5 tt -57.8 -45.49 85.99 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.808 0.337 . . . . 0.0 111.058 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -60.7 -56.24 23.6 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.985 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 730' ' ' LYS . . . . . 0.784 ' HE3' HG23 ' A' ' 727' ' ' ILE . 28.5 mtmt . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.878 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 619' ' ' TRP . . . . . 0.457 ' CE2' ' HD2' ' A' ' 725' ' ' LYS . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.16 0 CA-C-O 120.562 0.22 . . . . 0.0 111.43 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 116.63 158.25 11.24 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.438 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.81 -37.62 15.44 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.589 2.193 . . . . 0.0 112.048 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 622' ' ' ASN . . . . . 0.632 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 18.4 m-80 -67.73 -33.54 75.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.73 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 623' ' ' VAL . . . . . 0.451 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 60.5 t -70.15 -42.59 79.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.59 179.591 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 624' ' ' GLN . . . . . 0.406 ' OE1' HD12 ' A' ' 722' ' ' LEU . 42.6 tp60 -62.92 -38.11 89.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.46 179.609 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.37 -49.63 74.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.395 179.682 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 9.8 tt -67.7 -28.55 67.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.828 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -73.86 -49.21 26.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.139 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -58.81 -48.15 82.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.026 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 629' ' ' ILE . . . . . 0.55 HG22 HD11 ' A' ' 633' ' ' LEU . 20.5 mt -65.28 -38.84 83.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.984 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 630' ' ' LYS . . . . . 0.421 ' HA ' HD12 ' A' ' 633' ' ' LEU . 0.0 OUTLIER -62.02 -47.26 85.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.893 179.98 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -63.63 -40.22 96.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.984 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 632' ' ' HIS . . . . . 0.51 ' HB2' HD13 ' A' ' 717' ' ' LEU . 75.8 t60 -67.85 -42.89 80.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.858 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.598 HD13 ' SD ' ' A' ' 640' ' ' MET . 13.7 mt -56.58 -49.93 73.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.13 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -61.47 -41.54 97.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.67 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 11.8 t -73.56 -16.88 61.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.158 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 28.2 tp60 -93.72 -9.58 37.23 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.57 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 119.95 -10.08 11.19 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.576 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 638' ' ' ILE . . . . . 0.65 ' N ' HD12 ' A' ' 638' ' ' ILE . 3.3 mp -98.96 104.67 16.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.733 0.302 . . . . 0.0 111.114 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 1.2 m -77.18 113.12 14.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.889 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 640' ' ' MET . . . . . 0.598 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.9 mtp -128.37 31.01 5.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.887 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -62.89 -39.3 94.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.937 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -66.95 -77.83 0.07 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.001 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -176.43 140.96 0.53 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.839 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 644' ' ' PRO . . . . . 0.517 ' HB2' HD11 ' A' ' 651' ' ' LEU . 87.1 Cg_endo -78.23 147.95 23.71 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.604 2.203 . . . . 0.0 112.499 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 645' ' ' LEU . . . . . 0.689 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.8 tp -141.36 150.9 43.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.201 0.524 . . . . 0.0 111.159 179.677 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 646' ' ' ILE . . . . . 0.593 HD11 ' HA ' ' A' ' 695' ' ' LEU . 0.8 OUTLIER -149.58 132.99 7.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.634 179.004 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.04 41.02 59.43 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.339 -0.934 . . . . 0.0 112.176 -179.245 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 69.96 6.91 58.14 Favored Glycine 0 C--N 1.333 0.373 0 C-N-CA 120.969 -0.634 . . . . 0.0 113.786 179.317 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.8 m -131.23 162.13 30.69 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 117.372 0.586 . . . . 0.0 111.512 -179.131 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 650' ' ' GLU . . . . . 0.689 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.1 OUTLIER -77.92 144.04 37.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.773 179.775 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 651' ' ' LEU . . . . . 0.597 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -135.39 145.11 46.99 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.098 0.475 . . . . 0.0 111.296 -179.638 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -96.93 110.75 23.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.897 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 653' ' ' LEU . . . . . 0.415 ' HA ' HD13 ' A' ' 653' ' ' LEU . 3.5 mm? -52.19 -30.15 25.72 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.976 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 654' ' ' ALA . . . . . 0.632 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -71.69 -44.64 63.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.044 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 4.2 t -69.36 -34.42 74.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.547 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 656' ' ' PHE . . . . . 0.444 ' HD2' HD23 ' A' ' 651' ' ' LEU . 0.2 OUTLIER -71.29 -47.02 59.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.778 179.847 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 657' ' ' PHE . . . . . 0.457 ' HD1' HD21 ' A' ' 703' ' ' LEU . 89.4 t80 -56.83 -50.89 71.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.841 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 5.9 mtm180 -60.2 -41.63 93.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.718 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.66 -48.33 75.2 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.98 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 660' ' ' ILE . . . . . 0.742 HG21 ' HG2' ' A' ' 666' ' ' MET . 14.0 mt -59.94 -44.64 94.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.827 179.833 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 13.4 t30 -61.02 -44.43 97.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.888 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -67.14 -13.95 62.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.352 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 36.5 mmm -94.57 36.49 1.16 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.776 0.322 . . . . 0.0 111.102 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 65.04 44.24 94.64 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.588 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 81.51 172.73 47.21 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.549 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 666' ' ' MET . . . . . 0.742 ' HG2' HG21 ' A' ' 660' ' ' ILE . 0.0 OUTLIER -73.01 -31.66 64.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.744 0.307 . . . . 0.0 111.123 179.919 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 667' ' ' GLN . . . . . 0.405 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 12.6 pt20 -56.94 -44.09 82.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.185 -179.734 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 668' ' ' GLN . . . . . 0.415 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -64.87 -52.15 58.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.956 0.408 . . . . 0.0 110.842 -179.901 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 669' ' ' VAL . . . . . 0.654 HG21 HG23 ' A' ' 660' ' ' ILE . 80.4 t -49.25 -55.77 3.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.619 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 670' ' ' THR . . . . . 0.534 HG22 ' O ' ' A' ' 666' ' ' MET . 14.5 t -76.28 -50.29 14.76 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -178.572 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 671' ' ' ASP . . . . . 0.481 ' N ' HG23 ' A' ' 670' ' ' THR . 6.1 t0 -63.32 -51.25 66.79 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -177.546 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 672' ' ' LEU . . . . . 0.415 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 10.5 mp -76.68 2.68 13.48 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -178.918 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 48.89 85.62 0.03 OUTLIER 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.987 0.423 . . . . 0.0 110.494 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -147.13 22.07 1.21 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.209 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 675' ' ' TRP . . . . . 1.152 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 38.1 m95 -60.15 -27.47 67.11 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 121.358 0.599 . . . . 0.0 110.16 179.757 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -55.44 -44.36 76.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.714 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 12.1 mttm -77.08 -51.6 10.76 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 120.748 0.309 . . . . 0.0 111.539 -179.336 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 1.012 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.43 -40.94 72.15 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 109.786 -0.449 . . . . 0.0 109.786 179.694 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 679' ' ' ALA . . . . . 0.827 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.62 -35.06 70.33 Favored 'General case' 0 C--N 1.334 -0.073 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.828 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -53.21 -47.64 68.78 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.504 179.702 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -19.19 65.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.066 179.628 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 682' ' ' LEU . . . . . 0.495 HD23 ' O ' ' A' ' 678' ' ' LEU . 3.2 mm? -80.99 -2.8 49.35 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.632 -179.89 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 683' ' ' ARG . . . . . 0.771 ' C ' HD12 ' A' ' 684' ' ' ILE . 8.4 mmm180 73.68 71.88 0.12 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.869 0.366 . . . . 0.0 111.465 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 684' ' ' ILE . . . . . 0.771 HD12 ' C ' ' A' ' 683' ' ' ARG . 3.2 mp -134.25 138.46 30.41 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.323 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 685' ' ' PRO . . . . . 0.542 ' HD2' HG23 ' A' ' 684' ' ' ILE . 28.1 Cg_endo -63.0 125.35 15.7 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.498 2.132 . . . . 0.0 112.763 -179.514 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -69.96 -23.9 63.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.023 179.589 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.36 -23.93 67.11 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.289 -179.655 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -71.34 109.16 5.17 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.826 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -70.79 -68.88 0.4 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.971 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -52.52 -18.53 1.75 Allowed 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 691' ' ' ARG . . . . . 0.439 ' HD3' HD22 ' A' ' 692' ' ' LEU . 0.0 OUTLIER -50.25 -33.96 21.48 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.795 0.331 . . . . 0.0 110.779 179.764 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 692' ' ' LEU . . . . . 0.439 HD22 ' HD3' ' A' ' 691' ' ' ARG . 4.3 mm? -70.27 -48.04 58.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.913 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.1 -38.41 69.36 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.316 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 2.7 tptt -61.71 -40.63 95.7 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.088 0.47 . . . . 0.0 110.117 179.625 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 1.152 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.3 OUTLIER -66.89 -43.79 82.54 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.399 179.551 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.49 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 5.2 tp60 -55.42 -46.91 76.63 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.76 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -77.18 -29.37 54.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.753 179.591 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 698' ' ' ALA . . . . . 0.429 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -68.1 -40.58 82.57 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.64 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 699' ' ' TYR . . . . . 0.498 ' CD2' ' CZ2' ' A' ' 675' ' ' TRP . 0.7 OUTLIER -84.16 -31.13 25.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.955 0.407 . . . . 0.0 110.657 -179.94 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 700' ' ' CYS . . . . . 0.451 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 41.7 t -67.69 -30.4 69.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.877 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.14 -1.78 33.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.787 -179.684 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 702' ' ' TYR . . . . . 0.439 ' CE2' HG21 ' A' ' 638' ' ' ILE . 4.3 m-85 -115.55 -78.85 0.58 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.809 0.337 . . . . 0.0 111.7 -179.508 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 703' ' ' LEU . . . . . 0.457 HD21 ' HD1' ' A' ' 657' ' ' PHE . 2.7 tp -63.2 -38.85 92.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.829 -179.04 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.451 ' HB2' ' O ' ' A' ' 700' ' ' CYS . 0.6 OUTLIER -50.83 -56.66 11.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.471 -179.557 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 22.7 p -54.42 -49.32 70.23 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.173 -179.676 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 706' ' ' TYR . . . . . 0.637 ' O ' HD22 ' A' ' 709' ' ' LEU . 10.5 t80 -62.36 -29.14 70.25 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.345 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -96.8 -1.27 46.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.823 -179.563 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 1.5 t -112.31 -18.18 12.56 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.603 0.239 . . . . 0.0 111.501 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 709' ' ' LEU . . . . . 0.637 HD22 ' O ' ' A' ' 706' ' ' TYR . 0.2 OUTLIER -74.09 175.19 7.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.759 0.314 . . . . 0.0 110.992 -179.918 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.44 166.15 47.4 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.228 -179.761 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -67.94 -27.45 36.69 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.646 2.23 . . . . 0.0 112.119 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -52.2 -50.51 61.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.633 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 713' ' ' GLU . . . . . 0.462 ' HB2' ' CD1' ' A' ' 709' ' ' LEU . 3.3 mm-40 -58.08 -26.6 62.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.193 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 714' ' ' HIS . . . . . 0.581 ' CD2' HD21 ' A' ' 709' ' ' LEU . 5.6 m170 -75.88 -53.62 8.17 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.935 0.398 . . . . 0.0 110.61 179.732 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 4.4 tpp180 -59.78 -45.32 92.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.385 -179.647 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -54.23 31.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.443 -179.452 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 717' ' ' LEU . . . . . 0.51 HD13 ' HB2' ' A' ' 632' ' ' HIS . 71.2 mt -62.04 -44.06 97.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.816 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -64.72 -53.78 41.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.164 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 6.7 mmtt -50.15 -34.22 21.63 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.152 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 720' ' ' GLU . . . . . 0.437 ' O ' ' HG2' ' A' ' 723' ' ' MET . 1.1 mm-40 -68.16 -55.47 12.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.012 0.434 . . . . 0.0 110.404 179.521 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 31.3 t -62.84 -54.98 26.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.977 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 722' ' ' LEU . . . . . 0.406 HD12 ' OE1' ' A' ' 624' ' ' GLN . 1.2 mp -49.0 -43.76 40.52 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.765 -179.312 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 723' ' ' MET . . . . . 0.698 ' O ' HD12 ' A' ' 727' ' ' ILE . 17.4 ptp -73.6 -41.31 63.01 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.456 -0.498 . . . . 0.0 109.792 179.416 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -57.37 -29.47 64.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.461 -179.66 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 725' ' ' LYS . . . . . 0.457 ' HD2' ' CE2' ' A' ' 619' ' ' TRP . 9.4 ptmm? -86.02 -38.88 17.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.329 -179.694 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 726' ' ' GLU . . . . . 0.403 ' N ' ' HG3' ' A' ' 725' ' ' LYS . 1.7 mm-40 -71.3 -49.92 37.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.017 -179.782 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 727' ' ' ILE . . . . . 0.698 HD12 ' O ' ' A' ' 723' ' ' MET . 3.7 mp -88.36 11.45 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.629 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 1.6 tt -58.77 -49.48 77.49 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.824 0.345 . . . . 0.0 110.94 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -71.89 -46.1 58.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 10.3 mtpt . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.878 -179.965 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 619' ' ' TRP . . . . . 0.535 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.124 0 CA-C-O 120.671 0.272 . . . . 0.0 111.183 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 119.0 166.12 13.36 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.495 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -67.54 -36.49 19.64 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.508 2.139 . . . . 0.0 112.127 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -65.01 -42.17 94.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.842 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 623' ' ' VAL . . . . . 0.458 HG21 ' HB2' ' A' ' 619' ' ' TRP . 47.4 t -68.53 -37.09 77.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.926 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 624' ' ' GLN . . . . . 0.509 ' CG ' HD21 ' A' ' 722' ' ' LEU . 1.3 tm0? -62.1 -41.81 98.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.8 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.64 -47.03 76.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.679 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 7.1 tt -67.07 -26.62 66.82 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.96 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 627' ' ' ALA . . . . . 0.475 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -73.95 -54.06 8.74 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.363 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 30.8 p -57.92 -41.83 83.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.03 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 29.0 mt -69.28 -42.52 81.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.816 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.48 -43.87 98.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.765 179.801 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 1.6 tttm -63.01 -42.21 99.78 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.852 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 632' ' ' HIS . . . . . 0.64 ' HB2' HD13 ' A' ' 717' ' ' LEU . 77.8 t60 -67.41 -42.4 83.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.898 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.644 HD13 ' SD ' ' A' ' 640' ' ' MET . 58.0 mt -55.9 -49.48 73.3 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.338 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 634' ' ' ARG . . . . . 0.49 ' HG3' ' N ' ' A' ' 635' ' ' SER . 0.0 OUTLIER -64.22 -40.44 96.05 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.937 -179.972 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 635' ' ' SER . . . . . 0.49 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 0.1 OUTLIER -73.89 -16.09 61.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.142 179.765 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 636' ' ' GLN . . . . . 0.444 ' CG ' ' CE1' ' A' ' 632' ' ' HIS . 9.8 mm100 -94.44 -10.23 33.07 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.564 -179.669 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 120.22 -11.97 10.58 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.573 -0.822 . . . . 0.0 112.522 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 638' ' ' ILE . . . . . 0.456 HG21 ' CE2' ' A' ' 702' ' ' TYR . 5.3 mp -94.25 104.7 16.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 120.668 0.27 . . . . 0.0 111.194 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.42 109.08 15.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.844 0.354 . . . . 0.0 110.994 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 640' ' ' MET . . . . . 0.644 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.4 mtp -119.13 28.89 7.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.891 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -66.68 -31.84 72.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.888 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -72.73 -78.61 0.09 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.878 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 1.3 pp -178.87 126.79 0.26 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.947 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -75.54 131.03 13.26 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.459 2.106 . . . . 0.0 112.274 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 645' ' ' LEU . . . . . 0.445 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.1 tp -126.43 152.47 46.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.206 0.527 . . . . 0.0 111.13 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 646' ' ' ILE . . . . . 0.664 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.2 tt -149.57 133.26 8.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.832 179.174 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 54.15 38.87 62.27 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.239 -0.981 . . . . 0.0 111.93 -179.237 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.45 7.55 60.97 Favored Glycine 0 CA--C 1.52 0.389 0 C-N-CA 121.085 -0.579 . . . . 0.0 113.626 179.498 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 11.0 m -133.82 164.15 27.9 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 117.366 0.583 . . . . 0.0 111.557 -179.085 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 650' ' ' GLU . . . . . 0.445 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.2 OUTLIER -78.92 145.75 33.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.761 179.694 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 651' ' ' LEU . . . . . 0.613 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.94 145.05 47.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.406 -179.745 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -96.9 111.76 23.82 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.984 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 653' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 653' ' ' LEU . 3.8 mm? -53.06 -35.49 59.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.097 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -67.88 -46.19 72.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.231 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 4.7 t -69.15 -38.22 78.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.608 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 656' ' ' PHE . . . . . 0.48 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.3 OUTLIER -68.73 -47.25 66.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.892 179.813 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -60.33 -50.97 71.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.011 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -56.03 -43.44 77.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.102 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 659' ' ' LEU . . . . . 0.825 HD13 ' CD2' ' A' ' 682' ' ' LEU . 0.2 OUTLIER -57.68 -47.55 82.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.17 -179.782 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 660' ' ' ILE . . . . . 0.695 HG23 HG21 ' A' ' 669' ' ' VAL . 24.7 mt -56.87 -45.09 83.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.8 0.333 . . . . 0.0 110.825 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -62.41 -44.97 95.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.726 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -66.84 -14.13 62.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.251 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 663' ' ' MET . . . . . 0.404 ' CE ' ' HB3' ' A' ' 678' ' ' LEU . 0.0 OUTLIER -94.93 36.44 1.2 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.718 0.294 . . . . 0.0 110.979 -179.913 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 68.97 35.65 79.51 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.658 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 84.02 172.46 48.94 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.542 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 666' ' ' MET . . . . . 0.632 ' O ' HG22 ' A' ' 670' ' ' THR . 9.0 tpt -70.99 -28.94 64.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.66 0.267 . . . . 0.0 111.041 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 667' ' ' GLN . . . . . 0.442 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 12.4 pt20 -57.21 -43.74 83.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.25 -179.728 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 668' ' ' GLN . . . . . 0.431 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -66.63 -52.69 42.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.941 0.4 . . . . 0.0 110.913 179.979 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 669' ' ' VAL . . . . . 0.695 HG21 HG23 ' A' ' 660' ' ' ILE . 53.2 t -49.37 -55.65 3.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.627 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 670' ' ' THR . . . . . 0.632 HG22 ' O ' ' A' ' 666' ' ' MET . 14.9 t -76.39 -48.89 18.26 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 113.857 1.058 . . . . 0.0 113.857 -178.474 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 671' ' ' ASP . . . . . 0.458 ' N ' HG23 ' A' ' 670' ' ' THR . 17.5 t0 -65.65 -51.22 61.25 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -177.679 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 672' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 8.7 mp -76.92 3.24 12.56 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 -179.154 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 49.22 84.47 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.962 0.41 . . . . 0.0 110.426 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 1.9 ttmt -144.72 21.86 1.63 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.263 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 675' ' ' TRP . . . . . 1.149 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 36.3 m95 -60.26 -28.52 68.13 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.369 0.604 . . . . 0.0 110.089 179.694 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -55.64 -44.51 77.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.643 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 1.7 ttpt -76.85 -51.55 11.09 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 120.704 0.287 . . . . 0.0 111.634 -179.3 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 1.006 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.56 -41.84 73.83 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 179.798 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 679' ' ' ALA . . . . . 0.79 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.48 -34.18 69.94 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-O 120.875 0.369 . . . . 0.0 110.521 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.34 -46.35 69.47 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.389 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 4.9 ttm -65.52 -21.05 66.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.837 179.399 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 682' ' ' LEU . . . . . 0.825 ' CD2' HD13 ' A' ' 659' ' ' LEU . 2.7 mm? -79.96 -1.4 39.34 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.428 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 683' ' ' ARG . . . . . 0.795 ' C ' HD12 ' A' ' 684' ' ' ILE . 1.8 mpt_? 72.1 71.85 0.16 Allowed 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.959 0.409 . . . . 0.0 111.37 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 684' ' ' ILE . . . . . 0.795 HD12 ' C ' ' A' ' 683' ' ' ARG . 3.1 mp -133.57 138.28 30.78 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.328 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 685' ' ' PRO . . . . . 0.525 ' HD2' HG23 ' A' ' 684' ' ' ILE . 21.7 Cg_endo -61.68 125.3 16.36 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.591 2.194 . . . . 0.0 112.679 -179.514 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.86 -26.03 64.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.954 179.612 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.52 -23.84 66.98 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.224 -179.817 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -68.96 109.15 3.8 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.916 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -71.74 -68.93 0.42 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.889 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -51.4 -21.28 2.2 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.771 -179.578 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 691' ' ' ARG . . . . . 0.503 ' NH2' ' HB3' ' A' ' 679' ' ' ALA . 0.0 OUTLIER -49.87 -35.22 22.6 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.881 0.372 . . . . 0.0 110.687 179.677 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 692' ' ' LEU . . . . . 0.448 HD22 ' NE ' ' A' ' 691' ' ' ARG . 4.5 mm? -70.41 -47.21 61.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.074 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.13 -39.14 69.04 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.451 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 7.1 mttp -61.87 -41.32 97.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.09 0.471 . . . . 0.0 110.255 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 1.149 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.4 OUTLIER -67.32 -43.91 80.46 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.471 179.784 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.443 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 1.3 tt0 -55.24 -46.22 76.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.87 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -77.56 -29.69 52.31 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.074 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 698' ' ' ALA . . . . . 0.42 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.38 -39.25 85.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.544 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 699' ' ' TYR . . . . . 0.528 ' CZ ' ' HE2' ' A' ' 666' ' ' MET . 1.0 OUTLIER -84.99 -32.56 22.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.928 0.394 . . . . 0.0 110.512 179.881 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 700' ' ' CYS . . . . . 0.574 ' HA ' HD23 ' A' ' 704' ' ' LEU . 1.7 m -65.21 -30.28 71.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.714 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -100.91 -1.9 33.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.615 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 702' ' ' TYR . . . . . 0.456 ' CE2' HG21 ' A' ' 638' ' ' ILE . 4.8 m-85 -116.33 -79.59 0.59 Allowed 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 120.813 0.34 . . . . 0.0 111.524 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 1.6 tp -61.52 -40.51 94.89 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.722 -179.206 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.574 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.4 OUTLIER -48.31 -56.94 6.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.886 0.374 . . . . 0.0 111.429 -179.566 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 12.9 p -54.63 -47.33 73.61 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.383 -179.656 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 706' ' ' TYR . . . . . 0.63 ' O ' HD22 ' A' ' 709' ' ' LEU . 10.2 t80 -66.13 -29.44 69.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.591 -179.503 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -96.71 -0.09 48.8 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 6.9 t -116.92 -15.77 10.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.541 0.21 . . . . 0.0 111.523 -179.736 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 709' ' ' LEU . . . . . 0.63 HD22 ' O ' ' A' ' 706' ' ' TYR . 0.2 OUTLIER -73.96 175.14 7.65 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.751 0.31 . . . . 0.0 110.934 -179.949 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.41 164.51 59.14 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.958 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -66.5 -30.88 43.01 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.604 2.203 . . . . 0.0 111.961 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -48.94 -50.2 36.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.831 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 713' ' ' GLU . . . . . 0.449 ' HB2' ' CD1' ' A' ' 709' ' ' LEU . 3.5 mm-40 -58.26 -29.35 65.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.891 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 714' ' ' HIS . . . . . 0.485 ' CD2' ' CE1' ' A' ' 706' ' ' TYR . 1.8 m170 -75.76 -53.96 7.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.497 179.485 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 1.9 mtp-105 -60.22 -47.79 84.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.38 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.06 -54.05 40.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.553 -179.369 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 717' ' ' LEU . . . . . 0.64 HD13 ' HB2' ' A' ' 632' ' ' HIS . 84.8 mt -62.89 -42.38 99.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.128 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 718' ' ' GLU . . . . . 0.633 ' HG3' HD23 ' A' ' 722' ' ' LEU . 28.4 tt0 -67.37 -54.22 22.5 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.502 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -51.04 -33.66 26.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.323 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 720' ' ' GLU . . . . . 0.412 ' O ' ' HG2' ' A' ' 723' ' ' MET . 0.2 OUTLIER -69.42 -55.68 9.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.974 0.416 . . . . 0.0 110.563 179.8 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 721' ' ' VAL . . . . . 0.535 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 23.3 t -63.44 -54.94 26.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.143 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 722' ' ' LEU . . . . . 0.724 HD13 ' HE2' ' A' ' 725' ' ' LYS . 3.6 mm? -50.36 -43.29 54.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.779 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 723' ' ' MET . . . . . 0.62 ' HB2' HD13 ' A' ' 727' ' ' ILE . 13.4 ptp -72.12 -40.53 68.04 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.079 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 724' ' ' GLU . . . . . 0.429 ' N ' ' HG3' ' A' ' 723' ' ' MET . 2.2 mt-10 -52.41 -37.7 57.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.272 -179.727 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 725' ' ' LYS . . . . . 0.724 ' HE2' HD13 ' A' ' 722' ' ' LEU . 0.0 OUTLIER -86.05 -45.71 11.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.227 -179.786 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -59.67 -55.75 30.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.199 -179.709 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 727' ' ' ILE . . . . . 0.642 ' O ' HG22 ' A' ' 727' ' ' ILE . 4.2 mp -88.73 11.76 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.591 -179.811 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 7.3 tt -48.93 -31.73 7.82 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.757 0.313 . . . . 0.0 111.213 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -61.09 -46.21 91.57 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.858 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 730' ' ' LYS . . . . . 0.463 ' HB2' HG22 ' A' ' 727' ' ' ILE . 1.6 mtpt . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.208 -0.901 . . . . 0.0 110.807 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 619' ' ' TRP . . . . . 0.629 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.135 0 CA-C-O 120.67 0.271 . . . . 0.0 111.347 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 117.84 160.16 11.55 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.45 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -67.08 -33.73 30.81 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.57 2.18 . . . . 0.0 112.081 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 622' ' ' ASN . . . . . 0.441 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 19.5 m-80 -68.13 -34.8 77.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.813 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 623' ' ' VAL . . . . . 0.446 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 56.1 t -71.11 -45.32 72.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.582 179.576 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 624' ' ' GLN . . . . . 0.491 ' HG2' HD11 ' A' ' 722' ' ' LEU . 34.9 tp60 -59.47 -37.84 79.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.42 179.573 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.84 -50.75 69.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.256 179.431 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 9.3 tt -67.78 -28.69 67.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.712 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -72.03 -51.32 22.33 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.09 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.13 -47.85 80.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.935 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 629' ' ' ILE . . . . . 0.494 HG22 ' CD1' ' A' ' 633' ' ' LEU . 38.8 mt -63.63 -37.58 80.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.828 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp -63.88 -47.52 80.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.79 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 5.3 tttm -60.28 -40.1 89.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.875 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 632' ' ' HIS . . . . . 0.855 ' CD2' HD11 ' A' ' 709' ' ' LEU . 21.4 t-80 -70.87 -42.82 69.57 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.986 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.598 HD13 ' SD ' ' A' ' 640' ' ' MET . 20.1 mt -57.63 -50.06 74.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.222 -179.692 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 3.3 ptt85 -62.96 -44.12 96.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.817 0.341 . . . . 0.0 110.822 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.69 -11.56 60.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.221 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 636' ' ' GLN . . . . . 0.556 ' HG3' ' CE1' ' A' ' 632' ' ' HIS . 23.4 mm-40 -97.2 -7.84 31.43 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.572 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 111.89 6.75 24.32 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.375 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 638' ' ' ILE . . . . . . . . . . . . . 18.0 mt -117.03 107.86 23.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 CA-C-O 120.679 0.276 . . . . 0.0 111.318 -179.157 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -82.55 113.61 20.39 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.865 0.364 . . . . 0.0 110.791 179.743 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 640' ' ' MET . . . . . 0.598 ' SD ' HD13 ' A' ' 633' ' ' LEU . 2.0 ttp -124.15 35.45 4.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.883 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -69.53 -31.82 70.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.038 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 642' ' ' GLU . . . . . 0.415 ' O ' HD12 ' A' ' 643' ' ' LEU . 4.6 mm-40 -70.84 -79.01 0.07 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.971 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 643' ' ' LEU . . . . . 0.415 HD12 ' O ' ' A' ' 642' ' ' GLU . 0.1 OUTLIER -178.97 135.02 0.29 Allowed Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.845 179.964 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 644' ' ' PRO . . . . . 0.494 ' HB2' HD11 ' A' ' 651' ' ' LEU . 72.0 Cg_endo -74.69 138.61 24.07 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.523 2.149 . . . . 0.0 112.29 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 645' ' ' LEU . . . . . 0.655 HD12 ' HA ' ' A' ' 650' ' ' GLU . 5.0 tp -131.31 149.96 52.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.171 0.51 . . . . 0.0 111.134 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 646' ' ' ILE . . . . . 0.742 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.2 tt -146.84 131.8 11.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.568 178.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 52.36 44.2 58.23 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.283 -0.961 . . . . 0.0 112.226 -179.235 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 66.27 8.7 45.65 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 120.925 -0.655 . . . . 0.0 113.773 179.463 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 33.3 m -131.15 161.95 30.99 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 117.374 0.587 . . . . 0.0 111.377 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 650' ' ' GLU . . . . . 0.655 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.6 OUTLIER -80.09 143.53 33.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.768 179.897 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 651' ' ' LEU . . . . . 0.612 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -135.35 145.24 47.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.29 -179.692 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -97.33 110.79 23.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.886 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -52.14 -43.58 64.12 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.128 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 654' ' ' ALA . . . . . 0.441 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -60.89 -43.31 98.63 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.153 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 1.6 t -66.5 -35.5 80.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.803 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 656' ' ' PHE . . . . . 0.499 ' HD2' HD23 ' A' ' 651' ' ' LEU . 0.1 OUTLIER -72.78 -43.61 62.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.938 -179.98 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -59.7 -46.62 88.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.854 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 37.8 mtp180 -63.57 -43.87 95.77 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.048 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 659' ' ' LEU . . . . . 0.794 HD13 ' CD2' ' A' ' 682' ' ' LEU . 0.2 OUTLIER -59.36 -49.55 77.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.359 -179.67 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 660' ' ' ILE . . . . . 0.569 HD11 ' CH2' ' A' ' 675' ' ' TRP . 41.4 mt -56.83 -45.97 83.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.721 0.296 . . . . 0.0 110.889 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -66.88 -46.24 75.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.163 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -56.32 -21.38 23.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.548 -179.653 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.86 28.64 1.76 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.627 -0.26 . . . . 0.0 111.31 -179.765 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 90.49 -16.85 56.82 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.78 179.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 135.79 179.43 16.6 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.32 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 666' ' ' MET . . . . . 0.535 ' O ' HG22 ' A' ' 670' ' ' THR . 0.0 OUTLIER -72.64 -40.63 66.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.741 0.305 . . . . 0.0 111.199 -179.954 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 667' ' ' GLN . . . . . 0.404 ' HG2' ' N ' ' A' ' 668' ' ' GLN . 6.6 pm0 -51.13 -43.64 61.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.457 -179.548 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 668' ' ' GLN . . . . . 0.404 ' N ' ' HG2' ' A' ' 667' ' ' GLN . 0.0 OUTLIER -64.8 -52.44 56.82 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.879 0.371 . . . . 0.0 110.925 -179.926 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 669' ' ' VAL . . . . . 0.483 ' HB ' ' HE1' ' A' ' 666' ' ' MET . 89.5 t -49.33 -54.15 6.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.524 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 670' ' ' THR . . . . . 0.535 HG22 ' O ' ' A' ' 666' ' ' MET . 9.6 t -76.18 -54.3 7.01 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -178.563 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 671' ' ' ASP . . . . . 0.503 ' N ' HG23 ' A' ' 670' ' ' THR . 69.7 m-20 -56.88 -51.18 70.09 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -177.88 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 672' ' ' LEU . . . . . 0.404 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 7.9 mp -77.88 1.62 19.9 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -179.068 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 48.98 83.48 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.951 0.405 . . . . 0.0 110.439 -179.845 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 4.9 mtpm? -144.79 21.51 1.63 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.288 -179.584 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 675' ' ' TRP . . . . . 1.117 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 35.1 m95 -58.34 -29.16 65.72 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 121.338 0.589 . . . . 0.0 110.049 179.654 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 676' ' ' ASN . . . . . 0.414 ' CG ' HD11 ' A' ' 692' ' ' LEU . 15.5 m-80 -56.8 -41.27 77.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.676 -179.622 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 9.1 mttt -78.54 -51.95 9.2 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 120.774 0.321 . . . . 0.0 111.565 -179.353 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 1.012 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -56.77 -40.72 76.33 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 179.404 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 679' ' ' ALA . . . . . 0.796 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.94 -31.84 66.73 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.301 178.746 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.28 -48.18 68.53 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.038 179.379 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -62.04 -23.8 66.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.794 179.397 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 682' ' ' LEU . . . . . 0.794 ' CD2' HD13 ' A' ' 659' ' ' LEU . 3.0 mm? -79.59 -2.42 42.42 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.507 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 683' ' ' ARG . . . . . 0.775 ' C ' HD12 ' A' ' 684' ' ' ILE . 6.3 mmm180 70.49 72.01 0.21 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.933 0.397 . . . . 0.0 111.443 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 684' ' ' ILE . . . . . 0.775 HD12 ' C ' ' A' ' 683' ' ' ARG . 2.4 mp -128.52 141.78 42.63 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.456 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 685' ' ' PRO . . . . . 0.664 ' HD2' HG23 ' A' ' 684' ' ' ILE . 38.1 Cg_endo -68.16 121.33 8.31 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.261 1.974 . . . . 0.0 112.05 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -70.54 -25.08 62.94 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.432 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.37 -18.52 65.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.595 -179.515 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 688' ' ' ALA . . . . . 0.483 ' HB3' ' HB2' ' A' ' 691' ' ' ARG . . . -77.1 111.91 13.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.774 0.321 . . . . 0.0 111.425 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -83.17 -7.6 59.6 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.455 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -97.67 -27.58 14.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.148 0.499 . . . . 0.0 109.926 179.001 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 691' ' ' ARG . . . . . 0.483 ' HB2' ' HB3' ' A' ' 688' ' ' ALA . 0.3 OUTLIER -52.39 -46.72 66.38 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.32 -179.641 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 692' ' ' LEU . . . . . 0.451 ' HA ' HD13 ' A' ' 692' ' ' LEU . 3.8 mm? -59.74 -46.2 89.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.299 -179.658 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.42 -39.49 67.87 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.823 0.344 . . . . 0.0 111.411 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.39 -41.93 93.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.453 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 1.117 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 1.1 tp -64.7 -44.67 89.51 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.544 179.744 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.453 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 2.2 mm-40 -55.55 -47.75 75.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.879 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -76.41 -29.45 57.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.211 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 698' ' ' ALA . . . . . 0.402 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.56 -37.1 82.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.721 -179.648 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 699' ' ' TYR . . . . . 0.493 ' CZ ' ' HE3' ' A' ' 666' ' ' MET . 1.3 p90 -85.38 -36.83 20.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.932 0.396 . . . . 0.0 110.394 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 700' ' ' CYS . . . . . . . . . . . . . 5.3 m -62.77 -30.47 71.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.546 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -95.89 -4.93 42.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.392 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 702' ' ' TYR . . . . . 0.459 ' CD2' HD21 ' A' ' 633' ' ' LEU . 6.8 m-85 -121.56 -75.47 0.59 Allowed 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.838 0.352 . . . . 0.0 111.257 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -54.01 -48.91 69.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.476 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.424 HD23 ' CE1' ' A' ' 699' ' ' TYR . 1.3 mm? -54.9 -29.57 56.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.099 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 24.5 m -69.74 -55.4 10.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.424 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 706' ' ' TYR . . . . . 0.414 ' HA ' HD12 ' A' ' 709' ' ' LEU . 68.8 t80 -62.8 -29.57 70.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.931 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -85.5 -17.48 36.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.317 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 4.4 m -90.73 -21.91 21.35 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.84 0.352 . . . . 0.0 111.05 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 709' ' ' LEU . . . . . 0.855 HD11 ' CD2' ' A' ' 632' ' ' HIS . 60.6 mt -56.53 146.4 25.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.371 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 710' ' ' SER . . . . . 0.439 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.4 OUTLIER -79.39 167.67 32.56 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.607 179.732 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 711' ' ' PRO . . . . . 0.439 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 9.9 Cg_endo -53.15 -23.06 21.3 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.631 2.221 . . . . 0.0 112.401 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -70.18 -55.21 9.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.852 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 713' ' ' GLU . . . . . 0.562 ' O ' HD12 ' A' ' 717' ' ' LEU . 1.6 mm-40 -63.2 -25.95 68.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.845 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 9.9 m-70 -75.68 -54.69 6.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.116 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -64.9 -38.04 89.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.14 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 33.3 ttt180 -68.19 -54.11 20.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.104 -179.808 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 717' ' ' LEU . . . . . 0.596 ' O ' HG23 ' A' ' 721' ' ' VAL . 35.0 mt -64.58 -37.61 88.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.802 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 718' ' ' GLU . . . . . 0.401 ' O ' ' HB2' ' A' ' 722' ' ' LEU . 31.9 tt0 -71.24 -54.24 11.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.557 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 1.5 mmtt -52.4 -32.46 39.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.771 0.319 . . . . 0.0 111.191 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 720' ' ' GLU . . . . . 0.44 ' O ' ' HG2' ' A' ' 723' ' ' MET . 0.5 OUTLIER -70.02 -55.73 8.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.032 0.444 . . . . 0.0 110.468 179.652 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 721' ' ' VAL . . . . . 0.629 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 21.7 t -63.43 -53.49 44.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.183 -179.723 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 722' ' ' LEU . . . . . 0.491 HD11 ' HG2' ' A' ' 624' ' ' GLN . 1.2 mp -53.12 -41.0 64.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.998 -179.352 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 723' ' ' MET . . . . . 0.575 ' O ' HD12 ' A' ' 727' ' ' ILE . 14.0 ptp -72.0 -38.75 69.6 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.101 179.745 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 40.7 mm-40 -57.33 -33.64 67.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.117 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 725' ' ' LYS . . . . . 0.457 ' HD2' ' CE2' ' A' ' 619' ' ' TRP . 0.0 OUTLIER -86.14 -38.83 17.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.367 -179.704 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -68.41 -50.18 54.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.841 0.353 . . . . 0.0 111.13 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 727' ' ' ILE . . . . . 0.653 ' O ' HG22 ' A' ' 727' ' ' ILE . 4.3 mp -88.2 11.47 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.551 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 3.4 tt -59.49 -35.43 74.11 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.867 0.365 . . . . 0.0 110.906 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -79.86 -71.07 0.47 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.991 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 730' ' ' LYS . . . . . 0.546 ' HG3' HG23 ' A' ' 727' ' ' ILE . 13.1 ptmt . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.917 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 619' ' ' TRP . . . . . 0.614 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.1 OUTLIER . . . . . 0 CA--C 1.528 0.115 0 CA-C-O 120.58 0.228 . . . . 0.0 111.349 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 116.6 160.52 12.07 Favored Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.433 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -68.21 -39.03 10.97 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.541 2.161 . . . . 0.0 112.222 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 10.8 p30 -66.24 -34.22 77.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.885 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 623' ' ' VAL . . . . . 0.445 HG11 ' HB2' ' A' ' 619' ' ' TRP . 44.1 t -68.19 -45.65 82.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.712 179.669 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 624' ' ' GLN . . . . . 0.513 ' HG2' HD11 ' A' ' 722' ' ' LEU . 41.2 tp60 -60.95 -39.61 90.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.543 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 625' ' ' ARG . . . . . 0.484 ' O ' HD12 ' A' ' 629' ' ' ILE . 0.0 OUTLIER -59.52 -50.82 72.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.57 179.702 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 6.7 tt -68.51 -29.71 68.36 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.871 179.777 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -70.24 -50.27 41.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.373 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.5 -37.1 85.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.346 -179.646 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 629' ' ' ILE . . . . . 0.523 HD13 ' HB3' ' A' ' 653' ' ' LEU . 38.7 mt -63.86 -54.01 37.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.327 -179.746 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 630' ' ' LYS . . . . . 0.559 ' HB3' ' HE1' ' A' ' 640' ' ' MET . 0.9 OUTLIER -61.69 -32.41 72.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.269 -179.71 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 631' ' ' LYS . . . . . 0.425 ' N ' ' HG3' ' A' ' 630' ' ' LYS . 1.8 tttm -63.1 -50.96 68.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.84 0.352 . . . . 0.0 111.329 -179.704 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 632' ' ' HIS . . . . . 0.596 ' HB3' HD13 ' A' ' 717' ' ' LEU . 3.5 p-80 -68.31 -39.7 81.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.712 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.463 ' N ' ' CD2' ' A' ' 632' ' ' HIS . 41.8 mt -56.82 -49.84 74.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.144 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 634' ' ' ARG . . . . . 0.468 ' HG3' ' N ' ' A' ' 635' ' ' SER . 11.8 ptt180 -64.08 -39.34 93.85 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.781 0.324 . . . . 0.0 110.615 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 635' ' ' SER . . . . . 0.468 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 75.1 m -73.61 -17.24 61.19 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.011 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 636' ' ' GLN . . . . . 0.679 ' OE1' HD11 ' A' ' 709' ' ' LEU . 0.0 OUTLIER -93.0 -7.17 46.59 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.466 -179.823 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 111.86 3.69 26.53 Favored Glycine 0 C--N 1.331 0.305 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.601 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 638' ' ' ILE . . . . . 0.452 HG21 ' CZ ' ' A' ' 702' ' ' TYR . 17.3 mt -109.66 104.85 17.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-O 120.694 0.283 . . . . 0.0 111.284 -179.413 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -78.05 129.82 35.7 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.952 0.406 . . . . 0.0 111.061 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 640' ' ' MET . . . . . 0.559 ' HE1' ' HB3' ' A' ' 630' ' ' LYS . 0.2 OUTLIER -129.79 5.59 5.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.466 -179.948 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -58.56 -26.76 63.91 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.742 0.306 . . . . 0.0 111.248 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 642' ' ' GLU . . . . . 0.597 ' O ' HD12 ' A' ' 643' ' ' LEU . 28.9 mt-10 -66.43 -80.8 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.953 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 643' ' ' LEU . . . . . 0.597 HD12 ' O ' ' A' ' 642' ' ' GLU . 0.0 OUTLIER -177.11 118.52 0.26 Allowed Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.901 -179.98 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -65.53 134.49 38.57 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.425 2.083 . . . . 0.0 112.432 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 645' ' ' LEU . . . . . 0.645 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.6 tp -144.06 151.5 39.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.336 0.588 . . . . 0.0 111.441 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 646' ' ' ILE . . . . . 0.557 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.6 tt -149.65 133.49 8.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.228 -0.896 . . . . 0.0 109.705 178.963 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 52.65 40.73 56.08 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.302 -0.951 . . . . 0.0 112.218 -179.369 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.35 6.78 58.91 Favored Glycine 0 C--N 1.332 0.361 0 C-N-CA 120.986 -0.626 . . . . 0.0 113.839 179.334 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 6.3 m -132.08 163.04 29.34 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 117.413 0.606 . . . . 0.0 111.557 -179.173 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 650' ' ' GLU . . . . . 0.645 ' HA ' HD12 ' A' ' 645' ' ' LEU . 1.0 OUTLIER -78.94 144.27 34.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.727 179.77 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 651' ' ' LEU . . . . . 0.622 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.86 144.99 47.86 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.249 -179.751 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -96.58 110.75 23.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.875 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 653' ' ' LEU . . . . . 0.523 ' HB3' HD13 ' A' ' 629' ' ' ILE . 3.7 mm? -52.14 -32.68 36.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.163 -179.784 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -70.1 -44.41 69.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.166 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 14.4 t -69.1 -37.35 78.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.925 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 656' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -68.77 -45.9 70.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.884 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -58.36 -49.77 76.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.981 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 1.8 mtt85 -60.04 -42.48 94.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.817 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 659' ' ' LEU . . . . . 0.809 HD13 HD21 ' A' ' 682' ' ' LEU . 0.0 OUTLIER -57.67 -50.45 73.14 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.307 -179.729 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 660' ' ' ILE . . . . . 0.663 HD12 HD22 ' A' ' 703' ' ' LEU . 17.3 mt -56.71 -45.57 82.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.782 0.325 . . . . 0.0 110.841 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -63.47 -45.97 88.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.739 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -65.27 -19.97 66.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.2 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 8.9 mmm -90.2 36.67 0.88 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.477 -179.734 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 69.55 40.65 77.96 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.65 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 78.53 174.52 44.23 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.613 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 666' ' ' MET . . . . . 0.582 ' HG2' HG21 ' A' ' 660' ' ' ILE . 0.0 OUTLIER -73.01 -34.66 66.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.803 0.335 . . . . 0.0 111.287 -179.981 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -54.67 -45.7 73.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.434 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 668' ' ' GLN . . . . . 0.482 ' HA ' HD13 ' A' ' 672' ' ' LEU . 0.0 OUTLIER -62.58 -52.37 63.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.955 0.407 . . . . 0.0 110.774 179.943 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 669' ' ' VAL . . . . . 0.514 ' HB ' ' HE2' ' A' ' 666' ' ' MET . 75.1 t -49.21 -55.75 3.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.777 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 670' ' ' THR . . . . . 0.55 HG22 ' O ' ' A' ' 666' ' ' MET . 9.2 t -76.05 -51.65 11.84 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 -178.329 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 671' ' ' ASP . . . . . 0.496 ' N ' HG23 ' A' ' 670' ' ' THR . 4.0 t70 -60.0 -51.2 70.67 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -177.758 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 672' ' ' LEU . . . . . 0.482 HD13 ' HA ' ' A' ' 668' ' ' GLN . 10.7 mp -77.16 1.19 19.03 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -178.862 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 11.6 mtpp 49.36 87.21 0.03 OUTLIER 'General case' 0 CA--C 1.521 -0.163 0 CA-C-O 121.133 0.492 . . . . 0.0 110.385 -179.833 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -150.08 22.07 0.86 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.199 -179.678 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 675' ' ' TRP . . . . . 1.14 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 36.5 m95 -57.83 -28.49 64.13 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 121.444 0.64 . . . . 0.0 109.988 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 676' ' ' ASN . . . . . 0.403 ' O ' ' HB2' ' A' ' 680' ' ' ASP . 5.0 m-80 -55.18 -42.65 73.5 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.608 -179.672 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.78 -51.64 10.19 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.677 0.275 . . . . 0.0 111.662 -179.337 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 1.018 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -56.46 -40.07 74.25 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.827 -0.435 . . . . 0.0 109.827 179.771 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 679' ' ' ALA . . . . . 0.837 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.56 -35.64 70.67 Favored 'General case' 0 C--N 1.334 -0.079 0 CA-C-O 120.763 0.316 . . . . 0.0 110.567 179.199 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 680' ' ' ASP . . . . . 0.403 ' HB2' ' O ' ' A' ' 676' ' ' ASN . 6.0 t0 -53.03 -47.08 68.64 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.382 179.722 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 1.8 mtm -65.4 -22.51 66.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.872 179.448 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 682' ' ' LEU . . . . . 0.809 HD21 HD13 ' A' ' 659' ' ' LEU . 3.5 mm? -78.97 -2.15 38.76 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.576 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 683' ' ' ARG . . . . . 0.732 ' C ' HD12 ' A' ' 684' ' ' ILE . 3.4 mtp180 71.44 72.03 0.17 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.945 0.402 . . . . 0.0 111.608 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 684' ' ' ILE . . . . . 0.732 HD12 ' C ' ' A' ' 683' ' ' ARG . 3.2 mp -131.25 140.1 37.49 Favored Pre-proline 0 CA--C 1.532 0.262 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.282 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 685' ' ' PRO . . . . . 0.61 ' HD2' HG23 ' A' ' 684' ' ' ILE . 32.8 Cg_endo -64.85 123.24 11.35 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.52 2.147 . . . . 0.0 112.756 -179.464 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.97 -23.29 63.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.954 179.637 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.35 -23.73 67.06 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.272 -179.726 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -72.57 111.63 7.91 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.808 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -70.87 -68.83 0.41 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.952 -179.692 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -53.74 -15.71 1.37 Allowed 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -179.443 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 691' ' ' ARG . . . . . 0.433 ' NH2' ' HB3' ' A' ' 679' ' ' ALA . 0.0 OUTLIER -51.91 -35.28 44.94 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.79 0.329 . . . . 0.0 110.867 179.83 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 692' ' ' LEU . . . . . 0.431 HD22 ' N ' ' A' ' 692' ' ' LEU . 3.5 mm? -70.37 -46.85 63.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.938 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.0 -37.85 69.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.236 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 2.9 mmtp -62.61 -39.91 95.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.087 0.47 . . . . 0.0 110.07 179.674 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 1.14 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.4 OUTLIER -66.8 -44.67 80.62 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.44 179.609 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.47 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 3.0 mt-30 -55.22 -46.17 75.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.757 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -77.23 -29.47 54.14 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.878 179.595 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 698' ' ' ALA . . . . . 0.418 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -68.94 -39.5 79.53 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.775 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 699' ' ' TYR . . . . . 0.498 ' CZ ' ' HE1' ' A' ' 666' ' ' MET . 0.7 OUTLIER -85.77 -31.33 22.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.937 0.398 . . . . 0.0 110.562 179.971 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 700' ' ' CYS . . . . . 0.57 ' HA ' HD23 ' A' ' 704' ' ' LEU . 8.6 m -68.14 -30.24 69.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.648 179.601 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.0 -1.25 43.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.411 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 702' ' ' TYR . . . . . 0.452 ' CZ ' HG21 ' A' ' 638' ' ' ILE . 6.1 m-85 -118.69 -78.67 0.59 Allowed 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.871 0.367 . . . . 0.0 111.35 -179.739 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 703' ' ' LEU . . . . . 0.663 HD22 HD12 ' A' ' 660' ' ' ILE . 0.4 OUTLIER -59.24 -42.02 90.11 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.712 -179.243 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.57 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.6 OUTLIER -55.21 -41.61 72.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.874 0.369 . . . . 0.0 111.136 -179.71 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.45 -55.87 28.27 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.408 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 706' ' ' TYR . . . . . 0.483 ' HA ' HD12 ' A' ' 709' ' ' LEU . 3.1 t80 -56.34 -47.75 78.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.984 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -66.54 -18.57 65.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.133 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 24.9 p -91.36 -29.38 17.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.802 0.334 . . . . 0.0 110.904 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 709' ' ' LEU . . . . . 0.679 HD11 ' OE1' ' A' ' 636' ' ' GLN . 74.9 mt -61.32 157.56 16.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.902 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -79.11 165.66 47.32 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.711 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -55.52 -22.36 34.58 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.482 2.121 . . . . 0.0 112.172 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -61.87 -54.31 43.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.903 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 713' ' ' GLU . . . . . 0.585 ' HG3' HD22 ' A' ' 709' ' ' LEU . 52.6 mm-40 -60.45 -26.38 66.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.109 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 16.4 m170 -75.98 -54.42 6.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.479 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 715' ' ' ARG . . . . . 0.457 ' HG3' ' N ' ' A' ' 716' ' ' ARG . 0.8 OUTLIER -62.56 -41.33 98.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.464 -179.451 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 716' ' ' ARG . . . . . 0.457 ' N ' ' HG3' ' A' ' 715' ' ' ARG . 0.2 OUTLIER -66.92 -54.0 26.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.844 0.354 . . . . 0.0 111.061 -179.654 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 717' ' ' LEU . . . . . 0.596 HD13 ' HB3' ' A' ' 632' ' ' HIS . 59.9 mt -63.13 -41.24 99.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.969 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -69.17 -54.3 15.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.552 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.26 -32.35 24.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.167 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 720' ' ' GLU . . . . . 0.446 ' O ' ' HG2' ' A' ' 723' ' ' MET . 1.8 mt-10 -70.17 -55.55 9.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.047 0.451 . . . . 0.0 110.402 179.633 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 721' ' ' VAL . . . . . 0.614 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 20.0 t -62.59 -53.89 41.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.13 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 722' ' ' LEU . . . . . 0.513 HD11 ' HG2' ' A' ' 624' ' ' GLN . 1.1 mp -52.93 -41.3 64.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.046 -179.222 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 723' ' ' MET . . . . . 0.591 ' O ' HD12 ' A' ' 727' ' ' ILE . 15.2 ptp -72.97 -40.09 65.59 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.121 179.745 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -57.54 -31.31 65.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.321 -179.687 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 725' ' ' LYS . . . . . 0.439 ' HD3' ' CE2' ' A' ' 619' ' ' TRP . 3.4 pttp -86.14 -39.83 16.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.402 -179.763 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -69.86 -51.89 29.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.24 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 727' ' ' ILE . . . . . 0.627 ' O ' HG22 ' A' ' 727' ' ' ILE . 3.9 mp -87.7 11.63 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.733 -179.773 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 3.0 tt -56.27 -42.41 77.39 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.82 0.343 . . . . 0.0 111.007 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -75.22 -54.11 7.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.948 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 1.2 mtmm . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.899 179.98 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 619' ' ' TRP . . . . . 0.468 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.154 0 CA-C-O 120.6 0.238 . . . . 0.0 111.345 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 122.15 159.95 10.79 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.498 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -68.42 -32.68 25.01 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.555 2.17 . . . . 0.0 112.025 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 622' ' ' ASN . . . . . 0.506 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 6.8 p30 -70.74 -33.51 70.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.702 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 623' ' ' VAL . . . . . 0.468 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 57.0 t -76.04 -41.65 38.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.34 179.153 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 624' ' ' GLN . . . . . 0.699 ' CG ' HD11 ' A' ' 722' ' ' LEU . 7.8 tm0? -59.36 -40.45 86.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.253 179.514 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.53 -50.93 63.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.301 179.399 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 626' ' ' LEU . . . . . 0.709 HD13 ' O ' ' A' ' 626' ' ' LEU . 2.8 tm? -57.83 -39.49 77.77 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.653 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 627' ' ' ALA . . . . . 0.455 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -69.09 -52.59 26.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.282 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -56.92 -50.54 72.24 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.235 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 629' ' ' ILE . . . . . 0.599 HG22 HD11 ' A' ' 633' ' ' LEU . 25.6 mt -59.29 -39.53 79.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.153 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 7.0 ttpt -63.8 -49.64 72.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.919 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.32 -40.86 78.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.223 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 632' ' ' HIS . . . . . 0.907 ' CE1' HD11 ' A' ' 709' ' ' LEU . 85.6 t60 -71.67 -40.9 69.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.039 -179.86 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.745 HD13 ' SD ' ' A' ' 640' ' ' MET . 10.2 mt -56.83 -49.9 74.02 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.147 -179.74 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 1.5 ptt180 -65.71 -40.52 92.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.754 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 66.1 m -73.33 -13.74 61.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.25 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -98.06 -4.74 35.32 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 109.24 5.84 30.01 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.558 -0.83 . . . . 0.0 112.536 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 638' ' ' ILE . . . . . . . . . . . . . 18.1 mt -113.77 108.96 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-O 120.648 0.261 . . . . 0.0 111.277 -179.258 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -83.67 107.73 16.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.851 0.358 . . . . 0.0 110.913 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 640' ' ' MET . . . . . 0.745 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.6 ttp -117.09 35.14 4.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.817 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -74.61 -37.75 62.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.157 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -62.02 -82.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.052 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 1.7 pp -177.8 117.43 0.25 Allowed Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.949 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -59.33 150.94 71.55 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.406 2.071 . . . . 0.0 112.241 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 645' ' ' LEU . . . . . 0.692 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.7 tp -144.39 151.4 39.22 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.191 0.52 . . . . 0.0 111.405 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 646' ' ' ILE . . . . . 0.755 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.6 tt -149.81 133.87 8.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.688 178.864 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 52.57 40.12 54.6 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.34 -0.933 . . . . 0.0 112.282 -179.298 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.58 7.42 61.07 Favored Glycine 0 C--N 1.333 0.404 0 C-N-CA 120.964 -0.636 . . . . 0.0 113.658 179.388 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.7 m -131.99 162.35 30.92 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 117.346 0.573 . . . . 0.0 111.481 -179.271 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 650' ' ' GLU . . . . . 0.692 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.9 OUTLIER -77.77 143.84 37.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.825 179.809 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 651' ' ' LEU . . . . . 0.613 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -135.42 145.4 47.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.066 0.46 . . . . 0.0 111.426 -179.588 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -99.18 112.36 24.53 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.754 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 653' ' ' LEU . . . . . 0.403 ' HA ' HD13 ' A' ' 653' ' ' LEU . 3.7 mm? -52.64 -39.06 61.4 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.008 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 654' ' ' ALA . . . . . 0.506 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -64.14 -43.73 94.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.003 179.878 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 4.2 t -67.57 -39.67 84.91 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.043 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 656' ' ' PHE . . . . . 0.439 ' CE2' ' HG ' ' A' ' 682' ' ' LEU . 0.7 OUTLIER -67.44 -42.74 82.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.708 -179.983 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -59.7 -45.9 90.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.805 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 3.8 mtm180 -63.04 -43.21 99.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.538 179.834 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 659' ' ' LEU . . . . . 0.434 HD11 ' CE ' ' A' ' 681' ' ' MET . 0.6 OUTLIER -57.16 -51.45 69.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.966 179.972 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 660' ' ' ILE . . . . . 0.767 HG23 HG21 ' A' ' 669' ' ' VAL . 67.7 mt -57.68 -45.55 86.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.858 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -59.79 -39.69 85.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.82 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -61.15 -21.73 64.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.151 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 663' ' ' MET . . . . . 0.429 ' CE ' ' HB3' ' A' ' 678' ' ' LEU . 0.0 OUTLIER -88.47 14.38 9.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.627 -179.769 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 86.11 17.63 60.73 Favored Glycine 0 C--N 1.332 0.358 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.926 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 111.49 169.87 18.79 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.592 -0.813 . . . . 0.0 112.71 179.853 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 666' ' ' MET . . . . . 0.725 ' HG2' HG21 ' A' ' 660' ' ' ILE . 0.0 OUTLIER -63.83 -31.93 73.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.768 0.318 . . . . 0.0 111.046 -179.972 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -55.6 -48.19 75.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.443 -179.573 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 668' ' ' GLN . . . . . 0.401 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 12.8 mm100 -62.24 -52.59 63.13 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.842 0.354 . . . . 0.0 111.136 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 669' ' ' VAL . . . . . 0.767 HG21 HG23 ' A' ' 660' ' ' ILE . 60.7 t -50.92 -55.89 5.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.944 -179.649 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 670' ' ' THR . . . . . 0.523 HG23 ' N ' ' A' ' 671' ' ' ASP . 10.8 t -76.17 -53.07 8.82 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 -178.297 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 671' ' ' ASP . . . . . 0.523 ' N ' HG23 ' A' ' 670' ' ' THR . 4.4 t70 -57.32 -51.07 70.86 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -177.722 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 672' ' ' LEU . . . . . 0.401 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 9.1 mp -78.7 2.3 20.07 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -178.939 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 3.8 mmtp 48.27 86.09 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.076 0.465 . . . . 0.0 110.517 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -149.15 21.68 0.96 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.147 -179.855 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 675' ' ' TRP . . . . . 1.115 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 31.4 m95 -57.71 -28.4 63.82 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 121.327 0.584 . . . . 0.0 110.145 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -56.07 -42.05 76.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.853 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -77.49 -51.74 10.23 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 120.765 0.316 . . . . 0.0 111.665 -179.261 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 1.036 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -57.27 -40.55 77.96 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.677 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 679' ' ' ALA . . . . . 0.8 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.76 -33.63 68.81 Favored 'General case' 0 C--N 1.334 -0.082 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.412 178.93 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.16 -49.73 66.03 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.319 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 681' ' ' MET . . . . . 0.434 ' CE ' HD11 ' A' ' 659' ' ' LEU . 4.5 mtm -64.06 -22.37 66.9 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.867 179.366 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 682' ' ' LEU . . . . . 0.44 ' HB3' HD11 ' A' ' 684' ' ' ILE . 2.5 mm? -78.41 -3.34 42.77 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.526 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 683' ' ' ARG . . . . . 0.71 ' C ' HD12 ' A' ' 684' ' ' ILE . 23.9 mmt85 70.56 71.92 0.2 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.898 0.38 . . . . 0.0 111.546 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 684' ' ' ILE . . . . . 0.71 HD12 ' C ' ' A' ' 683' ' ' ARG . 2.1 mp -123.0 142.43 38.14 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.158 179.436 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 685' ' ' PRO . . . . . 0.698 ' HD2' HG23 ' A' ' 684' ' ' ILE . 53.5 Cg_endo -69.86 119.12 6.12 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.499 2.133 . . . . 0.0 112.634 -179.674 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.96 -23.04 63.12 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.045 179.658 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.23 -22.5 66.88 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.463 -179.635 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 688' ' ' ALA . . . . . 0.759 ' HB3' ' HG2' ' A' ' 691' ' ' ARG . . . -71.84 117.23 13.18 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.928 0.394 . . . . 0.0 111.075 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.25 3.82 29.61 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.37 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -121.69 -13.89 8.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.155 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 691' ' ' ARG . . . . . 0.826 ' HG3' HD22 ' A' ' 692' ' ' LEU . 0.2 OUTLIER -55.0 -35.1 64.0 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.811 0.338 . . . . 0.0 110.933 -179.673 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 692' ' ' LEU . . . . . 0.826 HD22 ' HG3' ' A' ' 691' ' ' ARG . 3.0 mm? -70.6 -47.69 58.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.042 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.93 -39.58 69.36 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.415 -179.793 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 3.8 mmtt -64.24 -40.78 96.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.241 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 1.115 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 3.9 tp -63.89 -47.04 82.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.844 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.431 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 0.0 OUTLIER -55.27 -49.09 72.96 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.189 -179.743 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -75.19 -29.49 60.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.126 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -68.54 -38.09 80.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.749 -179.587 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 699' ' ' TYR . . . . . 0.458 ' CD2' ' CZ2' ' A' ' 675' ' ' TRP . 1.0 OUTLIER -86.47 -30.52 21.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.831 0.348 . . . . 0.0 110.736 -179.877 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 700' ' ' CYS . . . . . . . . . . . . . 15.3 t -69.45 -30.51 68.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.644 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -97.46 -1.37 44.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.472 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 702' ' ' TYR . . . . . 0.593 ' CD2' HD21 ' A' ' 633' ' ' LEU . 7.1 m-85 -121.51 -78.64 0.6 Allowed 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.831 0.348 . . . . 0.0 111.316 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 703' ' ' LEU . . . . . 0.622 ' CD2' HD12 ' A' ' 660' ' ' ILE . 1.1 mp -57.63 -44.55 85.66 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.523 -179.444 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.431 HD23 ' CE1' ' A' ' 699' ' ' TYR . 1.1 mm? -56.4 -49.41 74.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.86 0.362 . . . . 0.0 110.959 -179.801 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 705' ' ' SER . . . . . 0.402 ' O ' ' HG ' ' A' ' 709' ' ' LEU . 22.7 m -54.7 -55.29 31.31 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.719 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 706' ' ' TYR . . . . . 0.599 ' HA ' HD12 ' A' ' 709' ' ' LEU . 56.4 t80 -63.77 -29.35 70.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.202 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -79.0 -20.96 47.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.247 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 1.7 m -91.54 -17.59 25.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.283 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 709' ' ' LEU . . . . . 0.907 HD11 ' CE1' ' A' ' 632' ' ' HIS . 78.2 mt -58.62 153.12 17.01 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.914 0.387 . . . . 0.0 111.113 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 710' ' ' SER . . . . . 0.451 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.6 OUTLIER -79.06 168.46 26.78 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.473 179.619 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 711' ' ' PRO . . . . . 0.451 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 14.4 Cg_endo -56.8 -19.78 32.72 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.518 2.145 . . . . 0.0 112.524 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -67.49 -55.55 13.13 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.038 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 713' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -59.34 -26.17 64.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.075 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -75.83 -54.1 7.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.256 179.419 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 7.0 mtm180 -63.44 -40.82 98.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.428 -179.594 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.54 -54.08 27.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.755 0.312 . . . . 0.0 111.241 -179.598 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 717' ' ' LEU . . . . . 0.635 HD13 ' HB2' ' A' ' 632' ' ' HIS . 57.8 mt -64.85 -39.39 93.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.975 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 718' ' ' GLU . . . . . 0.65 ' HG2' HD22 ' A' ' 722' ' ' LEU . 13.7 tt0 -69.29 -54.2 15.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.561 179.828 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 9.4 mmtt -52.89 -33.33 49.75 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.378 -179.714 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 720' ' ' GLU . . . . . 0.433 ' O ' ' HG2' ' A' ' 723' ' ' MET . 12.3 mt-10 -69.56 -55.76 9.23 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.079 0.466 . . . . 0.0 110.623 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 721' ' ' VAL . . . . . 0.455 HG11 ' HB1' ' A' ' 627' ' ' ALA . 45.8 t -63.76 -53.33 45.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.15 -179.636 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 722' ' ' LEU . . . . . 0.699 HD11 ' CG ' ' A' ' 624' ' ' GLN . 8.0 mp -54.4 -38.77 66.59 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.865 -179.173 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 723' ' ' MET . . . . . 0.499 ' HB2' HD13 ' A' ' 727' ' ' ILE . 13.6 ptp -75.38 -40.61 57.82 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.033 179.605 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -54.32 -40.02 67.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.178 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 725' ' ' LYS . . . . . 0.454 ' HE2' ' CD2' ' A' ' 619' ' ' TRP . 0.0 OUTLIER -85.45 -42.64 14.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.097 -179.86 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -59.51 -53.46 57.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.949 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 727' ' ' ILE . . . . . 0.643 ' O ' HG22 ' A' ' 727' ' ' ILE . 4.2 mp -89.37 11.7 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.551 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 728' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 725' ' ' LYS . 1.7 tt -57.34 -45.56 84.2 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.853 0.359 . . . . 0.0 111.049 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -73.86 -54.71 7.37 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.979 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 6.9 mtmm . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.981 179.998 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 619' ' ' TRP . . . . . 0.442 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.651 0.262 . . . . 0.0 111.284 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 126.11 163.21 11.49 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.491 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -68.52 -37.59 12.66 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.582 2.188 . . . . 0.0 112.241 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -67.35 -38.86 85.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.915 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 623' ' ' VAL . . . . . 0.442 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 40.1 t -70.98 -41.92 76.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.967 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 624' ' ' GLN . . . . . 0.499 ' CG ' HD21 ' A' ' 722' ' ' LEU . 1.2 tm0? -58.6 -45.53 88.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.712 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 74.5 mtt-85 -62.18 -50.63 71.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.708 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 626' ' ' LEU . . . . . 0.599 HD23 ' O ' ' A' ' 626' ' ' LEU . 8.6 tt -61.51 -34.09 74.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.819 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 627' ' ' ALA . . . . . 0.661 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -63.98 -53.76 45.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.185 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -58.97 -42.56 90.25 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.997 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 629' ' ' ILE . . . . . 0.453 HG23 ' HE1' ' A' ' 632' ' ' HIS . 38.3 mt -60.32 -51.39 73.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.048 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 4.7 ttpp -60.79 -32.82 72.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.249 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.67 -48.08 76.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.614 -179.507 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 632' ' ' HIS . . . . . 0.58 ' HB3' HD13 ' A' ' 717' ' ' LEU . 3.3 p-80 -69.47 -39.84 77.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.921 -179.747 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.512 HD13 ' SD ' ' A' ' 640' ' ' MET . 20.4 mt -55.86 -48.25 75.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.203 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 634' ' ' ARG . . . . . 0.433 ' HG3' ' N ' ' A' ' 635' ' ' SER . 0.1 OUTLIER -67.01 -39.92 87.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.719 0.295 . . . . 0.0 110.814 179.892 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 635' ' ' SER . . . . . 0.433 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 8.5 m -73.75 -14.03 61.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.42 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 636' ' ' GLN . . . . . 0.414 ' HB2' ' O ' ' A' ' 632' ' ' HIS . 0.0 OUTLIER -97.39 -8.26 29.91 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 -179.675 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 118.83 -8.46 12.86 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.583 179.696 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 638' ' ' ILE . . . . . 0.648 ' N ' HD12 ' A' ' 638' ' ' ILE . 3.5 mp -99.5 104.65 16.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.744 0.307 . . . . 0.0 111.03 -179.636 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 3.2 m -80.57 114.12 19.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.885 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 640' ' ' MET . . . . . 0.512 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.8 ttp -122.6 27.85 7.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.932 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.46 -52.8 59.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.888 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 642' ' ' GLU . . . . . 0.588 ' O ' HD12 ' A' ' 643' ' ' LEU . 0.6 OUTLIER -50.55 -72.39 0.05 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.23 -179.901 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 643' ' ' LEU . . . . . 0.588 HD12 ' O ' ' A' ' 642' ' ' GLU . 0.2 OUTLIER 179.67 134.4 0.25 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.81 179.843 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.13 122.96 7.47 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.455 2.103 . . . . 0.0 112.343 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 645' ' ' LEU . . . . . 0.612 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.9 tp -125.73 153.39 44.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.305 0.574 . . . . 0.0 111.319 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 646' ' ' ILE . . . . . 0.554 HD11 ' HA ' ' A' ' 695' ' ' LEU . 2.2 tt -149.62 133.17 7.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.448 179.156 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 50.59 43.61 45.97 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.246 -0.978 . . . . 0.0 112.138 -179.297 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 68.58 6.19 48.31 Favored Glycine 0 CA--C 1.52 0.378 0 C-N-CA 121.127 -0.559 . . . . 0.0 113.991 179.304 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 4.0 m -131.27 162.79 29.24 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 117.68 0.74 . . . . 0.0 111.696 -178.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 650' ' ' GLU . . . . . 0.612 ' HA ' HD12 ' A' ' 645' ' ' LEU . 2.5 mp0 -81.25 142.42 33.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.743 179.752 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 651' ' ' LEU . . . . . 0.644 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.11 144.76 48.78 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.071 0.462 . . . . 0.0 111.099 179.891 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.88 109.43 21.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.926 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -52.21 -42.62 63.69 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.083 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -62.78 -46.34 88.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.272 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 40.4 t -67.69 -37.58 82.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.911 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 656' ' ' PHE . . . . . 0.464 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.2 OUTLIER -68.82 -44.39 73.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.981 -179.898 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -59.96 -46.35 89.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.004 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.14 -43.89 98.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.009 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 659' ' ' LEU . . . . . 0.546 HD13 HD21 ' A' ' 682' ' ' LEU . 0.1 OUTLIER -56.7 -45.1 82.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.401 -179.65 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 660' ' ' ILE . . . . . 0.742 HG23 HG21 ' A' ' 669' ' ' VAL . 37.2 mt -62.97 -44.47 99.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.264 -179.845 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -64.3 -45.2 89.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.641 -179.427 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 662' ' ' GLU . . . . . 0.441 ' HG2' ' HA ' ' A' ' 659' ' ' LEU . 18.3 pt-20 -66.36 -14.15 61.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.598 -179.585 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.67 34.7 1.45 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.803 0.335 . . . . 0.0 111.199 -179.784 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 73.89 32.86 58.41 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.827 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 85.54 172.59 49.07 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.606 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 666' ' ' MET . . . . . 0.679 ' O ' HG22 ' A' ' 670' ' ' THR . 10.1 tpt -72.15 -28.87 63.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.643 0.259 . . . . 0.0 111.237 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -55.07 -48.29 73.72 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.106 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 668' ' ' GLN . . . . . 0.4 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -63.0 -51.86 65.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.856 0.36 . . . . 0.0 110.812 179.949 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 669' ' ' VAL . . . . . 0.742 HG21 HG23 ' A' ' 660' ' ' ILE . 40.7 t -49.19 -55.31 4.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.722 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 670' ' ' THR . . . . . 0.679 HG22 ' O ' ' A' ' 666' ' ' MET . 9.7 t -76.02 -50.69 14.12 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -178.372 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 671' ' ' ASP . . . . . 0.471 ' N ' HG23 ' A' ' 670' ' ' THR . 40.0 m-20 -62.14 -51.27 68.55 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -177.903 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 672' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 4.4 mm? -78.0 3.55 14.47 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -179.16 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 1.7 mttt 49.07 86.43 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.996 0.427 . . . . 0.0 110.477 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 27.7 mttt -144.88 22.21 1.59 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.229 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 675' ' ' TRP . . . . . 1.116 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 36.6 m95 -61.21 -30.34 70.37 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 121.409 0.624 . . . . 0.0 110.173 179.873 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -57.02 -43.29 81.69 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.372 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.18 -51.52 11.96 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.802 0.334 . . . . 0.0 111.243 -179.615 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.973 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.84 -40.29 72.62 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.572 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 679' ' ' ALA . . . . . 0.835 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.6 -33.68 69.23 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.551 179.107 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -53.77 -49.51 68.09 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.363 179.641 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 5.4 mtp -62.73 -22.21 66.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.763 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 682' ' ' LEU . . . . . 0.546 HD21 HD13 ' A' ' 659' ' ' LEU . 3.2 mm? -79.28 -1.13 35.22 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.457 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 683' ' ' ARG . . . . . 0.776 ' C ' HD12 ' A' ' 684' ' ' ILE . 0.0 OUTLIER 70.63 71.93 0.2 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.956 0.408 . . . . 0.0 111.343 179.98 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 684' ' ' ILE . . . . . 0.776 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.8 mp -124.43 136.99 28.45 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.682 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 685' ' ' PRO . . . . . 0.431 ' HD2' HG23 ' A' ' 684' ' ' ILE . 36.8 Cg_endo -65.99 125.2 13.75 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.474 2.116 . . . . 0.0 112.361 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.85 -13.94 62.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.393 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.3 -23.18 66.95 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.734 0.302 . . . . 0.0 111.207 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 688' ' ' ALA . . . . . 0.422 ' HB1' ' HG3' ' A' ' 691' ' ' ARG . . . -82.81 107.6 15.55 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.949 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -75.09 -68.33 0.56 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.206 -179.767 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 70.8 m-20 -54.6 -17.36 3.21 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.811 -179.696 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 691' ' ' ARG . . . . . 0.425 ' NH1' HG13 ' A' ' 684' ' ' ILE . 0.0 OUTLIER -45.93 -40.51 10.31 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.876 0.369 . . . . 0.0 111.299 179.859 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -59.69 -42.06 92.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.056 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.23 -37.23 69.21 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.892 0.377 . . . . 0.0 111.159 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -65.11 -42.96 93.47 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.29 179.544 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 1.116 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.4 OUTLIER -63.98 -43.91 94.31 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.422 179.67 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.445 ' O ' ' CD1' ' A' ' 699' ' ' TYR . 5.1 tp60 -56.17 -44.82 79.71 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.643 179.76 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -77.22 -29.8 54.32 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.176 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 698' ' ' ALA . . . . . 0.445 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.39 -37.53 83.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.729 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 699' ' ' TYR . . . . . 0.541 ' CZ ' ' HE2' ' A' ' 666' ' ' MET . 2.1 p90 -84.92 -37.62 20.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.969 0.414 . . . . 0.0 110.232 179.646 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 700' ' ' CYS . . . . . 0.642 ' HA ' HD23 ' A' ' 704' ' ' LEU . 15.3 t -60.88 -30.32 70.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.646 179.656 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -100.09 -0.42 39.06 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.453 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 702' ' ' TYR . . . . . 0.452 ' CZ ' HG21 ' A' ' 638' ' ' ILE . 5.1 m-85 -117.69 -79.05 0.59 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.78 0.324 . . . . 0.0 111.623 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 5.9 mp -64.41 -40.35 95.61 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.951 -179.039 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.642 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.4 OUTLIER -47.44 -56.63 6.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.806 0.336 . . . . 0.0 111.515 -179.593 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.28 -46.12 72.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.251 -179.547 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 706' ' ' TYR . . . . . 0.573 ' O ' HD22 ' A' ' 709' ' ' LEU . 10.2 t80 -61.95 -29.47 70.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.135 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -95.45 -4.46 45.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.497 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 8.6 p -112.52 -23.19 10.41 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.613 0.244 . . . . 0.0 111.378 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 709' ' ' LEU . . . . . 0.642 HD21 ' CD2' ' A' ' 714' ' ' HIS . 0.2 OUTLIER -70.15 172.61 7.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.812 0.339 . . . . 0.0 110.938 -179.942 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.6 165.57 51.86 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.098 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -68.42 -22.69 38.8 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.633 2.222 . . . . 0.0 112.191 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -52.3 -51.09 60.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.853 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 713' ' ' GLU . . . . . 0.552 ' HB2' HD11 ' A' ' 709' ' ' LEU . 1.6 mm-40 -57.96 -27.13 63.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.149 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 714' ' ' HIS . . . . . 0.642 ' CD2' HD21 ' A' ' 709' ' ' LEU . 24.8 m-70 -76.03 -53.8 7.81 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.669 179.61 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.53 -46.61 88.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.56 -179.44 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 716' ' ' ARG . . . . . 0.4 ' CG ' ' N ' ' A' ' 717' ' ' LEU . 4.7 ptt180 -67.54 -51.57 49.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.797 -179.188 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 717' ' ' LEU . . . . . 0.58 HD13 ' HB3' ' A' ' 632' ' ' HIS . 90.8 mt -64.57 -43.61 93.32 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.693 0.282 . . . . 0.0 111.072 -179.57 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 718' ' ' GLU . . . . . 0.62 ' HG3' HD23 ' A' ' 722' ' ' LEU . 10.8 tt0 -65.75 -54.17 30.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.242 179.723 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -50.46 -35.62 29.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.373 -179.834 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 720' ' ' GLU . . . . . 0.436 ' O ' ' HG2' ' A' ' 723' ' ' MET . 9.9 mt-10 -70.8 -55.47 8.49 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.933 0.397 . . . . 0.0 110.992 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 721' ' ' VAL . . . . . 0.661 HG11 ' HB1' ' A' ' 627' ' ' ALA . 22.0 t -63.63 -55.17 24.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.168 -179.487 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 722' ' ' LEU . . . . . 0.62 HD23 ' HG3' ' A' ' 718' ' ' GLU . 3.7 mm? -53.38 -42.37 66.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.999 -179.272 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 723' ' ' MET . . . . . 0.579 ' O ' HD12 ' A' ' 727' ' ' ILE . 14.1 ptp -68.66 -38.82 80.71 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 120.38 -0.528 . . . . 0.0 109.98 179.563 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -57.77 -35.02 70.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.157 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 725' ' ' LYS . . . . . 0.436 ' HD2' ' CE2' ' A' ' 619' ' ' TRP . 0.7 OUTLIER -86.11 -34.69 20.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.497 -179.654 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 726' ' ' GLU . . . . . 0.416 ' N ' ' HG3' ' A' ' 725' ' ' LYS . 10.3 mt-10 -72.37 -51.67 19.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.901 0.381 . . . . 0.0 111.189 -179.64 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 727' ' ' ILE . . . . . 0.632 ' O ' HG22 ' A' ' 727' ' ' ILE . 4.2 mp -87.55 11.68 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.647 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 8.5 tp -55.23 -56.22 22.43 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.775 0.322 . . . . 0.0 111.261 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -56.92 -49.05 76.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.266 -179.603 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.324 -0.846 . . . . 0.0 110.905 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 619' ' ' TRP . . . . . 0.607 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.164 0 CA-C-O 120.584 0.23 . . . . 0.0 111.464 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 118.22 166.45 13.74 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.49 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.31 -39.84 5.05 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.501 2.134 . . . . 0.0 112.363 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 622' ' ' ASN . . . . . 0.459 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 29.5 m-80 -63.78 -36.87 85.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.952 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 623' ' ' VAL . . . . . 0.46 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 48.6 t -68.64 -45.56 81.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.884 179.737 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 624' ' ' GLN . . . . . 0.561 ' HG2' HD21 ' A' ' 722' ' ' LEU . 27.7 tp60 -59.65 -36.92 77.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.527 179.713 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 625' ' ' ARG . . . . . 0.433 ' HD3' ' CE2' ' A' ' 657' ' ' PHE . 0.1 OUTLIER -63.36 -50.79 68.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.509 179.694 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 6.3 tt -67.16 -27.5 67.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.921 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -73.47 -42.97 61.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.287 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.02 -34.92 73.9 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.176 -179.802 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 19.5 mt -68.94 -49.11 66.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.323 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.86 -35.8 81.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.932 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 631' ' ' LYS . . . . . 0.41 ' O ' ' HG2' ' A' ' 634' ' ' ARG . 0.1 OUTLIER -64.52 -44.08 92.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.993 0.425 . . . . 0.0 110.702 179.775 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 632' ' ' HIS . . . . . 0.458 ' CG ' HD11 ' A' ' 709' ' ' LEU . 35.7 t60 -69.64 -41.63 75.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.806 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.414 ' CD2' ' CD2' ' A' ' 702' ' ' TYR . 42.6 mt -57.14 -49.93 74.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.145 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 634' ' ' ARG . . . . . 0.41 ' HG2' ' O ' ' A' ' 631' ' ' LYS . 0.0 OUTLIER -62.32 -43.5 98.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.709 179.793 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.58 -14.1 61.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.33 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 37.2 tp60 -96.5 -8.18 32.76 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 111.649 0.241 . . . . 0.0 111.649 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 115.13 0.43 22.46 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.52 179.784 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 638' ' ' ILE . . . . . 0.566 HG21 ' CZ ' ' A' ' 702' ' ' TYR . 14.7 mt -109.41 104.93 17.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 120.766 0.317 . . . . 0.0 111.192 -179.494 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 1.3 m -83.28 104.14 13.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.048 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 640' ' ' MET . . . . . 0.405 ' HE2' HD12 ' A' ' 633' ' ' LEU . 0.0 OUTLIER -98.28 25.96 5.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.818 179.854 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -78.06 -33.11 51.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.812 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -59.49 -73.4 0.09 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.84 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 179.13 118.41 0.21 Allowed Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.877 179.822 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.76 127.75 16.76 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.364 2.042 . . . . 0.0 111.967 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 645' ' ' LEU . . . . . 0.629 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.3 tp -142.68 152.54 42.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.407 0.623 . . . . 0.0 111.836 -179.857 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 646' ' ' ILE . . . . . 0.517 HD11 ' HA ' ' A' ' 695' ' ' LEU . 3.0 tt -149.86 133.53 8.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.552 178.772 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 51.59 41.75 50.25 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.223 -0.989 . . . . 0.0 112.222 -179.359 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.22 5.61 54.58 Favored Glycine 0 CA--C 1.521 0.466 0 C-N-CA 121.065 -0.588 . . . . 0.0 113.971 179.31 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.8 m -130.89 162.36 29.83 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 117.561 0.681 . . . . 0.0 111.66 -179.084 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 650' ' ' GLU . . . . . 0.629 ' HA ' HD12 ' A' ' 645' ' ' LEU . 1.6 mp0 -79.2 144.21 34.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.787 179.763 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 651' ' ' LEU . . . . . 0.635 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -135.25 144.98 47.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.098 0.475 . . . . 0.0 111.433 -179.737 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.71 111.15 23.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.821 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -52.23 -43.41 64.27 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.146 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 654' ' ' ALA . . . . . 0.459 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -59.25 -45.6 90.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.206 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 37.2 t -68.9 -33.9 74.53 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.756 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 656' ' ' PHE . . . . . 0.456 ' CE1' ' HB2' ' A' ' 651' ' ' LEU . 0.8 OUTLIER -68.54 -46.2 70.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.006 179.966 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 657' ' ' PHE . . . . . 0.433 ' CE2' ' HD3' ' A' ' 625' ' ' ARG . 75.7 t80 -60.82 -48.55 81.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.137 -179.816 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.13 -45.52 87.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.262 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 659' ' ' LEU . . . . . 0.847 HD13 ' CD2' ' A' ' 682' ' ' LEU . 0.1 OUTLIER -57.44 -51.0 71.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.547 -179.498 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 660' ' ' ILE . . . . . 0.734 HG23 HG21 ' A' ' 669' ' ' VAL . 53.3 mt -56.75 -44.54 81.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.751 0.31 . . . . 0.0 110.831 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -62.6 -45.13 94.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.786 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -64.48 -14.99 59.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.355 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 1.7 mmm -94.21 28.06 2.64 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.704 0.288 . . . . 0.0 111.214 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 76.03 33.94 48.68 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.641 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 87.23 171.91 47.71 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.535 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 666' ' ' MET . . . . . 0.575 ' O ' HG22 ' A' ' 670' ' ' THR . 10.7 tpt -70.73 -26.48 63.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.699 0.285 . . . . 0.0 111.218 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 667' ' ' GLN . . . . . 0.417 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 20.0 pt20 -58.3 -46.49 86.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.067 -179.79 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 668' ' ' GLN . . . . . 0.588 ' HA ' HD13 ' A' ' 672' ' ' LEU . 12.1 mm100 -64.9 -52.75 54.77 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.901 0.382 . . . . 0.0 110.971 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 669' ' ' VAL . . . . . 0.734 HG21 HG23 ' A' ' 660' ' ' ILE . 47.5 t -49.13 -55.89 3.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.816 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 670' ' ' THR . . . . . 0.575 HG22 ' O ' ' A' ' 666' ' ' MET . 12.6 t -76.23 -47.3 24.44 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -178.394 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 671' ' ' ASP . . . . . 0.44 ' N ' HG23 ' A' ' 670' ' ' THR . 15.4 t0 -66.54 -51.14 59.76 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -177.865 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 672' ' ' LEU . . . . . 0.588 HD13 ' HA ' ' A' ' 668' ' ' GLN . 7.9 mp -76.08 1.93 14.24 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -179.08 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 6.1 tttp 49.87 84.2 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.024 0.44 . . . . 0.0 110.614 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.02 21.63 1.41 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.026 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 675' ' ' TRP . . . . . 1.112 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 31.1 m95 -59.16 -31.7 69.22 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.324 0.583 . . . . 0.0 110.219 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -54.56 -42.97 71.61 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.785 -179.509 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.97 -51.49 11.05 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 120.706 0.289 . . . . 0.0 111.565 -179.327 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 1.008 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.72 -42.52 75.41 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.813 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 679' ' ' ALA . . . . . 0.75 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.64 -33.15 68.68 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 120.84 0.352 . . . . 0.0 110.589 179.037 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.23 -49.32 67.05 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.532 179.601 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 7.0 mtm -64.08 -21.12 66.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.856 179.577 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 682' ' ' LEU . . . . . 0.847 ' CD2' HD13 ' A' ' 659' ' ' LEU . 2.9 mm? -78.96 -1.7 36.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.399 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 683' ' ' ARG . . . . . 0.809 ' C ' HD12 ' A' ' 684' ' ' ILE . 13.5 mmm180 73.17 71.7 0.13 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 121.0 0.428 . . . . 0.0 111.39 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 684' ' ' ILE . . . . . 0.809 HD12 ' C ' ' A' ' 683' ' ' ARG . 2.7 mp -131.72 140.35 38.01 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.135 179.557 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 685' ' ' PRO . . . . . 0.634 ' HD2' HG23 ' A' ' 684' ' ' ILE . 34.7 Cg_endo -65.1 123.09 11.06 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.518 2.145 . . . . 0.0 112.68 -179.611 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.79 -26.2 64.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.96 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 3.1 p -65.36 -21.6 66.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.095 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -71.8 111.08 6.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.871 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 25.7 mm-40 -71.67 -68.92 0.42 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.093 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -52.94 -19.21 2.42 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.909 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 691' ' ' ARG . . . . . 0.502 ' HD2' HG22 ' A' ' 684' ' ' ILE . 0.0 OUTLIER -53.4 -34.69 58.68 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.75 0.31 . . . . 0.0 110.726 179.753 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -70.33 -52.94 19.01 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.175 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -69.36 -36.48 76.9 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.357 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 2.0 tmmm? -63.81 -41.28 97.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.135 0.493 . . . . 0.0 110.003 179.487 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 1.112 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.7 OUTLIER -63.37 -44.92 93.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.421 179.533 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.42 ' O ' ' CD1' ' A' ' 699' ' ' TYR . 43.2 mt-30 -55.53 -44.82 77.06 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.744 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -77.34 -29.78 53.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.206 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 698' ' ' ALA . . . . . 0.409 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.12 -39.05 86.57 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.62 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 699' ' ' TYR . . . . . 0.492 ' CE2' ' HE2' ' A' ' 666' ' ' MET . 1.7 p90 -83.77 -37.49 22.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.017 0.437 . . . . 0.0 110.244 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 700' ' ' CYS . . . . . 0.503 ' HA ' HD23 ' A' ' 704' ' ' LEU . 1.3 m -59.95 -31.71 70.12 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.485 179.708 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.53 -11.06 32.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.223 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 702' ' ' TYR . . . . . 0.566 ' CZ ' HG21 ' A' ' 638' ' ' ILE . 4.0 m-85 -114.44 -76.56 0.58 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.9 0.381 . . . . 0.0 111.405 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -54.66 -49.85 69.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.733 -179.361 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.503 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.5 OUTLIER -49.61 -45.45 48.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.851 0.357 . . . . 0.0 111.353 -179.607 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 2.3 m -55.38 -55.27 33.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.731 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 706' ' ' TYR . . . . . 0.478 ' HA ' HD12 ' A' ' 709' ' ' LEU . 71.5 t80 -64.59 -30.42 71.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.018 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -78.6 -18.62 54.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.423 -179.833 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 1.7 t -93.13 -19.89 21.04 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.785 0.326 . . . . 0.0 110.97 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 709' ' ' LEU . . . . . 0.741 HD22 ' CB ' ' A' ' 713' ' ' GLU . 49.6 mt -51.48 141.51 15.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.555 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 710' ' ' SER . . . . . 0.439 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.5 OUTLIER -78.03 167.97 31.39 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.5 179.586 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 711' ' ' PRO . . . . . 0.439 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 9.2 Cg_endo -52.58 -22.91 18.05 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.517 2.145 . . . . 0.0 112.374 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -75.98 -55.89 5.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.982 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 713' ' ' GLU . . . . . 0.741 ' CB ' HD22 ' A' ' 709' ' ' LEU . 2.3 mm-40 -58.54 -27.26 64.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.021 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 8.7 m-70 -75.85 -53.96 7.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.432 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.05 -36.48 83.72 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.148 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.43 -54.36 21.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.827 0.346 . . . . 0.0 111.089 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 717' ' ' LEU . . . . . 0.414 ' O ' HG23 ' A' ' 721' ' ' VAL . 83.6 mt -64.42 -40.62 96.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.712 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 718' ' ' GLU . . . . . 0.557 ' HG3' HD23 ' A' ' 722' ' ' LEU . 24.4 tt0 -67.33 -54.03 24.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.398 179.631 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt -50.72 -35.01 29.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.315 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 720' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' A' ' 723' ' ' MET . 10.4 mt-10 -67.77 -55.61 12.4 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.993 0.425 . . . . 0.0 110.544 179.748 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 721' ' ' VAL . . . . . 0.607 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 33.2 t -63.75 -54.73 28.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.106 -179.691 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 722' ' ' LEU . . . . . 0.764 HD13 ' HE2' ' A' ' 725' ' ' LYS . 0.8 OUTLIER -49.06 -44.03 41.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.874 -179.31 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 723' ' ' MET . . . . . 0.537 ' HB2' HD13 ' A' ' 727' ' ' ILE . 16.9 ptp -72.77 -39.9 66.4 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.15 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -50.86 -41.83 58.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.64 -179.305 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 725' ' ' LYS . . . . . 0.764 ' HE2' HD13 ' A' ' 722' ' ' LEU . 0.0 OUTLIER -86.08 -36.82 19.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.686 0.279 . . . . 0.0 111.315 -179.751 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -62.48 -53.61 52.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.989 0.423 . . . . 0.0 110.945 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 727' ' ' ILE . . . . . 0.655 ' O ' HG22 ' A' ' 727' ' ' ILE . 4.6 mp -88.49 11.57 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.552 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 8.7 tt -56.79 -34.17 67.38 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.774 0.321 . . . . 0.0 110.995 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -90.53 -48.32 7.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.938 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 22.6 mtmt . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.852 -179.966 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 619' ' ' TRP . . . . . 0.553 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.462 0.151 0 CA-C-O 120.674 0.273 . . . . 0.0 111.297 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 123.55 164.96 12.17 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.329 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -65.64 -40.8 16.56 Favored 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 122.453 2.102 . . . . 0.0 112.191 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -59.85 -43.25 94.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.918 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 623' ' ' VAL . . . . . 0.452 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 38.3 t -71.54 -38.05 66.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.913 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 624' ' ' GLN . . . . . 0.669 ' CG ' HD11 ' A' ' 722' ' ' LEU . 1.0 OUTLIER -54.3 -45.39 72.54 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.661 179.787 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 8.3 mtt180 -70.68 -39.77 73.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.343 179.423 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 626' ' ' LEU . . . . . 0.8 HD13 ' O ' ' A' ' 626' ' ' LEU . 3.1 tm? -63.28 -32.27 73.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.768 179.663 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 627' ' ' ALA . . . . . 0.496 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -72.9 -48.26 38.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.319 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -57.03 -46.56 82.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.951 -179.783 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 629' ' ' ILE . . . . . 0.428 HG22 ' CD1' ' A' ' 633' ' ' LEU . 10.4 mt -66.38 -38.95 82.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.929 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 15.5 ttpt -64.22 -39.52 94.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.935 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.13 -42.41 89.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.817 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 632' ' ' HIS . . . . . 0.866 ' CE1' HD11 ' A' ' 709' ' ' LEU . 84.1 t60 -70.52 -41.44 72.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.796 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.428 ' CD1' HG22 ' A' ' 629' ' ' ILE . 49.7 mt -58.27 -49.73 76.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.291 -179.718 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 634' ' ' ARG . . . . . 0.442 ' HG3' ' N ' ' A' ' 635' ' ' SER . 3.8 ptt180 -65.79 -38.77 89.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.983 -179.853 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 635' ' ' SER . . . . . 0.442 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 0.3 OUTLIER -73.71 -20.38 60.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.091 179.77 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 636' ' ' GLN . . . . . 0.423 ' CG ' ' CE1' ' A' ' 632' ' ' HIS . 32.4 mm-40 -88.93 -5.25 58.11 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.665 -179.661 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 109.97 -0.85 30.09 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.418 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 638' ' ' ILE . . . . . 0.511 HG21 ' CE2' ' A' ' 702' ' ' TYR . 13.9 mt -103.21 104.62 16.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 CA-C-O 120.703 0.287 . . . . 0.0 111.127 -179.612 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.11 108.43 17.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.899 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 1.6 mtp -119.87 28.6 8.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.864 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -60.99 -33.0 72.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.835 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -67.48 -78.62 0.06 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.904 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 643' ' ' LEU . . . . . 0.488 HD13 ' OE2' ' A' ' 650' ' ' GLU . 0.7 OUTLIER 178.06 129.81 0.21 Allowed Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.901 179.888 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 644' ' ' PRO . . . . . 0.466 ' HB2' HD11 ' A' ' 651' ' ' LEU . 57.1 Cg_endo -70.98 130.86 18.49 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.413 2.075 . . . . 0.0 112.223 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 645' ' ' LEU . . . . . 0.62 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.4 tp -124.12 151.78 43.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.272 0.558 . . . . 0.0 111.455 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 646' ' ' ILE . . . . . 0.548 HG22 ' HB3' ' A' ' 651' ' ' LEU . 0.8 OUTLIER -149.66 132.9 7.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.614 178.982 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.21 40.95 60.69 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.304 -179.385 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.08 5.43 58.54 Favored Glycine 0 C--N 1.334 0.439 0 C-N-CA 120.989 -0.624 . . . . 0.0 113.875 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -132.26 163.79 27.83 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 117.447 0.624 . . . . 0.0 111.432 -179.115 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 650' ' ' GLU . . . . . 0.62 ' HA ' HD12 ' A' ' 645' ' ' LEU . 3.6 mt-10 -79.29 145.74 33.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.822 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 651' ' ' LEU . . . . . 0.584 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -135.69 145.05 46.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.11 0.481 . . . . 0.0 111.599 -179.57 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.91 112.33 24.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.97 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 6.7 mp -61.08 -33.78 73.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.076 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -64.58 -47.57 78.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.935 0.398 . . . . 0.0 110.942 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 53.3 t -70.34 -33.07 71.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.271 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 656' ' ' PHE . . . . . 0.47 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.3 OUTLIER -69.1 -46.28 68.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.569 179.624 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -58.17 -52.76 64.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.091 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -57.84 -41.34 82.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.823 0.344 . . . . 0.0 110.789 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 659' ' ' LEU . . . . . 0.572 HD21 ' CE ' ' A' ' 681' ' ' MET . 0.2 OUTLIER -55.03 -46.0 75.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.124 179.93 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 660' ' ' ILE . . . . . 0.708 HD11 ' CH2' ' A' ' 675' ' ' TRP . 12.6 mt -63.2 -42.33 96.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.045 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -62.21 -46.15 90.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.114 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 71.4 tt0 -72.86 -9.54 58.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.474 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 1.4 mmm -95.03 36.66 1.19 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.765 0.317 . . . . 0.0 111.125 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 66.91 38.43 92.89 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.364 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 79.96 172.23 43.76 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.453 -179.856 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 666' ' ' MET . . . . . 0.792 ' O ' HG22 ' A' ' 670' ' ' THR . 9.7 tpt -72.15 -27.19 62.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.654 0.264 . . . . 0.0 111.256 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -57.53 -48.85 78.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.437 -179.586 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 668' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -63.19 -42.87 99.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.837 0.351 . . . . 0.0 111.296 -179.68 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 669' ' ' VAL . . . . . 0.651 HG12 ' CD1' ' A' ' 675' ' ' TRP . 40.2 t -61.81 -53.35 49.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.785 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 670' ' ' THR . . . . . 0.792 HG22 ' O ' ' A' ' 666' ' ' MET . 10.1 t -75.75 -49.66 17.53 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -178.615 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 671' ' ' ASP . . . . . 0.436 ' N ' HG23 ' A' ' 670' ' ' THR . 51.2 m-20 -63.09 -51.01 68.28 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -178.672 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 22.6 mt -87.04 10.87 15.17 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 111.895 0.332 . . . . 0.0 111.895 -179.362 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 10.5 ttpp 46.67 77.19 0.09 Allowed 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 120.929 0.395 . . . . 0.0 110.506 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.52 6.71 14.74 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.706 -179.371 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 675' ' ' TRP . . . . . 0.795 ' HA ' HD22 ' A' ' 678' ' ' LEU . 77.1 m95 -65.05 -22.73 67.02 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.7 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -59.16 -51.68 68.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.845 0.355 . . . . 0.0 111.022 -179.519 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 5.1 tptt -78.0 -47.18 19.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.167 0.508 . . . . 0.0 110.193 179.402 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.795 HD22 ' HA ' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -52.97 -46.41 68.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.176 179.297 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 679' ' ' ALA . . . . . 0.655 ' O ' HD13 ' A' ' 684' ' ' ILE . . . -71.27 -35.68 71.45 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.213 179.769 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -52.87 -48.08 67.37 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.778 0.323 . . . . 0.0 110.863 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 681' ' ' MET . . . . . 0.572 ' CE ' HD21 ' A' ' 659' ' ' LEU . 1.8 ttp -65.3 -20.69 66.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.861 179.527 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 682' ' ' LEU . . . . . 0.467 ' HG ' ' CE2' ' A' ' 656' ' ' PHE . 2.1 mm? -80.06 -3.43 48.54 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.523 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 683' ' ' ARG . . . . . 0.808 ' C ' HD12 ' A' ' 684' ' ' ILE . 0.5 OUTLIER 74.89 71.72 0.1 Allowed 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.936 0.398 . . . . 0.0 111.318 179.874 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 684' ' ' ILE . . . . . 0.808 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.8 mp -125.13 138.1 30.98 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.21 179.631 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 685' ' ' PRO . . . . . 0.505 ' HD2' HG23 ' A' ' 684' ' ' ILE . 41.1 Cg_endo -68.42 121.32 8.26 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.364 2.043 . . . . 0.0 112.567 -179.654 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 686' ' ' LYS . . . . . 0.571 ' NZ ' HG23 ' A' ' 687' ' ' THR . 3.0 pptp? -69.76 -18.71 63.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.184 179.79 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 687' ' ' THR . . . . . 0.571 HG23 ' NZ ' ' A' ' 686' ' ' LYS . 0.2 OUTLIER -65.23 -20.47 66.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.299 -179.766 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 688' ' ' ALA . . . . . 0.761 ' HB3' ' HG2' ' A' ' 691' ' ' ARG . . . -65.02 117.65 7.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.899 0.381 . . . . 0.0 110.87 179.778 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.13 7.83 14.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.557 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -138.84 -0.19 1.93 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.442 179.573 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 691' ' ' ARG . . . . . 0.761 ' HG2' ' HB3' ' A' ' 688' ' ' ALA . 2.5 ptt180 -56.48 -33.94 66.45 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.764 0.316 . . . . 0.0 111.068 -179.585 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 692' ' ' LEU . . . . . 0.707 ' O ' HD23 ' A' ' 695' ' ' LEU . 0.5 OUTLIER -70.17 -53.09 18.67 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.927 0.394 . . . . 0.0 110.996 -179.943 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.98 -37.18 69.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.828 0.346 . . . . 0.0 111.565 -179.657 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.44 -41.29 98.67 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.361 -179.495 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 0.713 HD11 ' HB3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -72.95 -40.01 65.73 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.969 -0.293 . . . . 0.0 110.654 179.972 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.509 ' N ' HD23 ' A' ' 695' ' ' LEU . 0.0 OUTLIER -55.33 -44.6 76.02 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.29 0.567 . . . . 0.0 109.752 179.126 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -77.6 -29.46 51.92 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.754 179.075 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 698' ' ' ALA . . . . . 0.415 ' HB3' ' HA ' ' A' ' 695' ' ' LEU . . . -66.78 -40.68 88.26 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.878 -179.647 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 699' ' ' TYR . . . . . 0.558 ' CE2' HD23 ' A' ' 704' ' ' LEU . 2.6 p90 -80.82 -40.4 25.02 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.833 0.349 . . . . 0.0 110.441 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 700' ' ' CYS . . . . . 0.439 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 0.7 OUTLIER -58.86 -33.03 70.0 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.784 179.909 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -94.4 -4.57 48.17 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.68 -179.719 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 702' ' ' TYR . . . . . 0.511 ' CE2' HG21 ' A' ' 638' ' ' ILE . 8.3 m-85 -123.3 -76.58 0.59 Allowed 'General case' 0 C--O 1.231 0.126 0 CA-C-O 120.791 0.329 . . . . 0.0 111.38 -179.786 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 703' ' ' LEU . . . . . 0.433 HD13 HD12 ' A' ' 660' ' ' ILE . 25.5 mt -56.31 -45.95 80.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.488 -179.356 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.558 HD23 ' CE2' ' A' ' 699' ' ' TYR . 0.4 OUTLIER -47.62 -54.34 12.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.956 0.407 . . . . 0.0 111.284 -179.792 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 705' ' ' SER . . . . . 0.415 ' O ' ' HG ' ' A' ' 709' ' ' LEU . 0.1 OUTLIER -54.57 -48.34 72.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.97 -179.846 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 706' ' ' TYR . . . . . 0.524 ' HA ' HD12 ' A' ' 709' ' ' LEU . 46.6 t80 -64.51 -31.61 72.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.052 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -79.57 -16.28 56.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.306 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -97.44 -19.75 18.22 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.771 0.319 . . . . 0.0 111.13 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 709' ' ' LEU . . . . . 0.866 HD11 ' CE1' ' A' ' 632' ' ' HIS . 45.7 mt -55.31 151.36 9.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.998 0.428 . . . . 0.0 111.466 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 710' ' ' SER . . . . . 0.429 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.3 OUTLIER -80.05 171.73 11.66 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.597 179.753 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 711' ' ' PRO . . . . . 0.429 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 60.1 Cg_endo -72.38 -6.75 19.67 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.494 2.129 . . . . 0.0 112.862 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -74.57 -56.62 4.63 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.854 0.359 . . . . 0.0 110.943 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 713' ' ' GLU . . . . . 0.741 ' OE1' HD13 ' A' ' 709' ' ' LEU . 2.8 pp20? -61.06 -25.79 67.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.033 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -73.23 -54.1 9.26 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.167 179.571 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 26.5 ttt180 -60.13 -40.69 90.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.11 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.47 -53.94 12.28 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.324 -179.702 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 717' ' ' LEU . . . . . 0.566 HD12 ' OE1' ' A' ' 713' ' ' GLU . 76.8 mt -60.6 -43.26 97.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.863 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 718' ' ' GLU . . . . . 0.724 ' HG3' HD13 ' A' ' 722' ' ' LEU . 36.3 tt0 -63.86 -54.03 41.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.361 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 10.8 mmtt -50.38 -35.07 26.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.292 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 720' ' ' GLU . . . . . 0.44 ' O ' ' HG2' ' A' ' 723' ' ' MET . 1.5 mm-40 -70.39 -55.31 9.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.981 0.419 . . . . 0.0 110.93 179.866 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 721' ' ' VAL . . . . . 0.553 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 39.2 t -63.77 -55.15 24.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.179 -179.568 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 722' ' ' LEU . . . . . 0.724 HD13 ' HG3' ' A' ' 718' ' ' GLU . 7.1 mp -53.48 -41.94 66.75 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.1 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 723' ' ' MET . . . . . 0.59 ' O ' HD12 ' A' ' 727' ' ' ILE . 5.8 ptp -68.92 -38.83 79.79 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.052 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 724' ' ' GLU . . . . . 0.405 ' N ' ' HG3' ' A' ' 723' ' ' MET . 2.0 mt-10 -59.68 -35.38 74.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.145 -179.793 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 725' ' ' LYS . . . . . 0.447 ' HD3' ' CE2' ' A' ' 619' ' ' TRP . 10.0 pttt -86.15 -37.8 18.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.433 -179.663 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 726' ' ' GLU . . . . . 0.405 ' N ' ' HG3' ' A' ' 725' ' ' LYS . 3.5 mm-40 -70.11 -50.42 40.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.308 -179.524 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 727' ' ' ILE . . . . . 0.647 ' O ' HG22 ' A' ' 727' ' ' ILE . 4.1 mp -88.09 11.64 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.697 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 2.8 tt -57.68 -35.73 70.97 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.835 0.35 . . . . 0.0 110.952 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -63.04 -51.52 66.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.994 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 3.6 mtpt . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.18 -0.914 . . . . 0.0 110.927 -179.941 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 619' ' ' TRP . . . . . 0.551 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.462 0.172 0 CA-C-O 120.705 0.288 . . . . 0.0 111.275 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 126.99 169.49 12.72 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.424 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -69.19 -33.65 18.27 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.589 2.193 . . . . 0.0 112.195 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 622' ' ' ASN . . . . . 0.556 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 46.6 m-80 -68.25 -43.34 78.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.849 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 623' ' ' VAL . . . . . 0.492 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 38.6 t -71.85 -39.58 67.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.897 179.783 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 624' ' ' GLN . . . . . 0.64 ' CG ' HD11 ' A' ' 722' ' ' LEU . 0.9 OUTLIER -56.55 -50.39 72.03 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.868 179.928 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 625' ' ' ARG . . . . . 0.437 ' NH2' HD11 ' A' ' 629' ' ' ILE . 6.9 mmm180 -64.44 -43.39 94.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.769 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 626' ' ' LEU . . . . . 0.619 HD23 ' O ' ' A' ' 626' ' ' LEU . 4.1 tt -59.65 -36.93 77.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.046 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 627' ' ' ALA . . . . . 0.41 ' CB ' HG11 ' A' ' 721' ' ' VAL . . . -72.36 -45.8 58.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.365 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.1 -47.11 81.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.167 -179.77 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 629' ' ' ILE . . . . . 0.437 HD11 ' NH2' ' A' ' 625' ' ' ARG . 8.5 mt -65.74 -42.49 92.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.098 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.75 -45.16 91.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.169 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 2.1 tttp -59.8 -43.86 94.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.19 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 632' ' ' HIS . . . . . 0.704 ' HB2' HD13 ' A' ' 717' ' ' LEU . 86.3 t60 -68.91 -40.89 78.86 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.119 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.455 HD12 ' CE ' ' A' ' 640' ' ' MET . 46.2 mt -57.49 -47.46 81.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.171 -179.737 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -64.14 -43.25 95.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.827 0.346 . . . . 0.0 110.605 179.726 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 20.2 m -73.67 -11.74 60.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.303 179.642 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 636' ' ' GLN . . . . . 0.403 ' HG3' ' NE2' ' A' ' 632' ' ' HIS . 32.2 mm-40 -97.46 -9.6 26.93 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.654 -179.75 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 118.57 -8.7 13.25 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.268 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 638' ' ' ILE . . . . . 0.502 HG21 ' CZ ' ' A' ' 702' ' ' TYR . 10.4 mt -100.57 104.64 16.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.649 0.261 . . . . 0.0 111.001 -179.78 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.82 109.49 15.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.086 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 640' ' ' MET . . . . . 0.455 ' CE ' HD12 ' A' ' 633' ' ' LEU . 1.6 mtm -113.64 25.15 11.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.82 179.759 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.98 -47.76 49.82 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.865 -179.925 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 642' ' ' GLU . . . . . 0.773 ' O ' HD12 ' A' ' 643' ' ' LEU . 0.2 OUTLIER -49.59 -72.6 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.096 -179.938 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 643' ' ' LEU . . . . . 0.773 HD12 ' O ' ' A' ' 642' ' ' GLU . 0.0 OUTLIER -178.05 117.66 0.25 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.821 179.86 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -67.97 119.82 6.83 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.393 2.062 . . . . 0.0 112.097 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 645' ' ' LEU . . . . . 0.516 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.4 tp -131.15 154.96 47.8 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.402 0.62 . . . . 0.0 111.651 -179.724 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 646' ' ' ILE . . . . . 0.559 HD11 ' HA ' ' A' ' 695' ' ' LEU . 2.3 tt -149.94 134.2 8.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.54 178.966 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 50.14 41.65 38.9 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.214 -0.993 . . . . 0.0 112.12 -179.343 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.16 5.74 54.74 Favored Glycine 0 CA--C 1.522 0.507 0 C-N-CA 121.025 -0.607 . . . . 0.0 113.812 179.428 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -131.82 162.54 30.32 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 117.553 0.677 . . . . 0.0 111.541 -179.089 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 650' ' ' GLU . . . . . 0.516 ' HA ' HD12 ' A' ' 645' ' ' LEU . 5.2 mt-10 -81.38 144.33 31.52 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.85 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 651' ' ' LEU . . . . . 0.617 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.78 145.07 48.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.191 179.988 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -95.27 110.41 22.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.883 -179.92 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 653' ' ' LEU . . . . . 0.444 HD22 ' CD2' ' A' ' 651' ' ' LEU . 4.0 mm? -52.85 -36.07 58.35 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.025 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 654' ' ' ALA . . . . . 0.556 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -69.31 -47.09 65.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.042 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 19.3 t -65.91 -41.78 91.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.629 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 656' ' ' PHE . . . . . 0.423 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.1 OUTLIER -67.37 -44.13 79.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.739 179.805 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -56.52 -51.71 67.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.885 179.898 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 11.2 ttt180 -58.58 -40.85 84.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.773 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 659' ' ' LEU . . . . . 0.49 HD12 ' HB2' ' A' ' 678' ' ' LEU . 0.2 OUTLIER -55.61 -45.62 77.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.102 -179.947 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 660' ' ' ILE . . . . . 0.715 HG23 HG21 ' A' ' 669' ' ' VAL . 33.0 mt -66.11 -44.27 91.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.265 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -61.25 -41.51 97.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.386 -179.615 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -72.3 -10.34 59.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.61 -179.661 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.74 36.58 1.38 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.76 0.314 . . . . 0.0 111.186 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 68.63 28.81 72.91 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.628 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 92.32 171.37 41.26 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.593 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 666' ' ' MET . . . . . 0.575 ' SD ' HG21 ' A' ' 660' ' ' ILE . 10.6 tpt -71.59 -30.87 66.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.758 0.313 . . . . 0.0 111.254 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -55.15 -44.92 75.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.139 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 668' ' ' GLN . . . . . 0.417 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -65.23 -52.19 56.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.898 0.38 . . . . 0.0 110.942 179.922 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 669' ' ' VAL . . . . . 0.715 HG21 HG23 ' A' ' 660' ' ' ILE . 48.7 t -49.02 -54.75 4.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.592 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 670' ' ' THR . . . . . 0.565 HG22 ' O ' ' A' ' 666' ' ' MET . 12.9 t -76.22 -50.68 13.83 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 -178.59 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 671' ' ' ASP . . . . . 0.473 ' N ' HG23 ' A' ' 670' ' ' THR . 70.0 m-20 -61.18 -51.18 70.09 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -177.909 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 672' ' ' LEU . . . . . 0.417 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 10.4 mp -76.22 1.62 15.42 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -178.907 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 2.9 mmmt 50.14 85.19 0.03 OUTLIER 'General case' 0 C--O 1.232 0.138 0 CA-C-O 121.042 0.448 . . . . 0.0 110.387 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 7.4 mtmt -147.88 19.88 1.14 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.209 -179.701 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 675' ' ' TRP . . . . . 1.146 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 26.4 m95 -55.77 -29.24 59.31 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-O 121.428 0.632 . . . . 0.0 110.199 179.816 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -57.34 -42.9 82.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.684 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 11.1 mmtp -76.32 -51.83 11.18 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 111.668 0.248 . . . . 0.0 111.668 -179.269 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 1.046 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -57.32 -41.3 79.68 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 179.528 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 679' ' ' ALA . . . . . 0.782 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.72 -30.01 65.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.208 178.779 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.44 -51.56 66.53 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.295 179.57 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -60.53 -22.5 63.68 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.644 179.405 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 682' ' ' LEU . . . . . 0.413 ' HB2' ' O ' ' A' ' 679' ' ' ALA . 2.5 mm? -78.89 -2.2 38.74 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.445 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 683' ' ' ARG . . . . . 0.739 ' C ' HD12 ' A' ' 684' ' ' ILE . 1.1 mmt180 71.88 71.85 0.16 Allowed 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.962 0.41 . . . . 0.0 110.867 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 684' ' ' ILE . . . . . 0.739 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.7 mp -122.56 135.76 25.96 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.927 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.29 122.59 10.11 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.418 2.078 . . . . 0.0 112.3 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 1.5 mmtm -70.0 -17.28 63.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.245 179.804 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 1.1 p -65.46 -22.81 66.79 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.321 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 688' ' ' ALA . . . . . 0.471 ' HB1' ' HG3' ' A' ' 691' ' ' ARG . . . -84.58 105.18 15.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.871 0.367 . . . . 0.0 110.905 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 -70.49 -68.46 0.43 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.181 -179.595 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -52.76 -19.55 2.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.871 -179.583 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 691' ' ' ARG . . . . . 0.471 ' HG3' ' HB1' ' A' ' 688' ' ' ALA . 0.0 OUTLIER -48.09 -37.1 14.45 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.856 0.36 . . . . 0.0 111.171 179.922 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -64.23 -42.97 96.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.006 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.05 -36.78 69.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.971 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 3.5 tttt -65.67 -41.69 92.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.128 179.602 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 1.146 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.2 OUTLIER -64.59 -41.93 95.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.279 179.51 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.461 ' O ' ' CD1' ' A' ' 699' ' ' TYR . 0.0 OUTLIER -57.85 -44.16 86.36 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.663 179.706 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -77.37 -29.79 53.47 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.128 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 698' ' ' ALA . . . . . 0.437 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.39 -37.68 83.49 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.716 -179.7 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 699' ' ' TYR . . . . . 0.549 ' CZ ' ' HE2' ' A' ' 666' ' ' MET . 2.1 p90 -84.26 -39.06 19.73 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.945 0.402 . . . . 0.0 110.305 179.689 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 700' ' ' CYS . . . . . 0.446 ' HA ' HD23 ' A' ' 704' ' ' LEU . 13.7 t -60.03 -30.54 69.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.567 179.758 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -97.89 -3.49 38.49 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.451 179.865 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 702' ' ' TYR . . . . . 0.502 ' CZ ' HG21 ' A' ' 638' ' ' ILE . 5.3 m-85 -117.98 -74.94 0.59 Allowed 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.862 0.363 . . . . 0.0 111.278 -179.719 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 703' ' ' LEU . . . . . 0.598 ' CD2' HD12 ' A' ' 660' ' ' ILE . 1.1 mp -60.91 -46.8 89.21 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.677 -179.263 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.447 HD23 ' CE2' ' A' ' 699' ' ' TYR . 0.7 OUTLIER -52.76 -50.76 62.86 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.925 0.393 . . . . 0.0 111.072 -179.812 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 705' ' ' SER . . . . . 0.565 ' O ' HD13 ' A' ' 709' ' ' LEU . 0.3 OUTLIER -54.6 -54.84 36.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.719 179.935 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 706' ' ' TYR . . . . . 0.467 ' CE2' ' CE1' ' A' ' 714' ' ' HIS . 23.8 t80 -47.18 -43.12 20.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.97 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -93.79 -0.82 55.67 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.246 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.06 -16.43 56.8 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.453 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 709' ' ' LEU . . . . . 0.583 ' H ' HD13 ' A' ' 709' ' ' LEU . 0.0 OUTLIER -95.71 -173.35 2.84 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.833 0.349 . . . . 0.0 111.51 -179.642 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 710' ' ' SER . . . . . 0.416 ' O ' HD23 ' A' ' 709' ' ' LEU . 0.3 OUTLIER -86.71 165.47 32.35 Favored Pre-proline 0 C--N 1.332 -0.158 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.192 -179.705 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 711' ' ' PRO . . . . . 0.402 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 14.5 Cg_endo -56.87 -18.78 28.93 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.772 2.315 . . . . 0.0 112.972 -179.782 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -60.04 -54.16 49.24 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.93 0.395 . . . . 0.0 110.81 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 713' ' ' GLU . . . . . 0.455 ' HB2' ' HG ' ' A' ' 709' ' ' LEU . 2.7 mm-40 -61.28 -25.93 67.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.932 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 714' ' ' HIS . . . . . 0.467 ' CE1' ' CE2' ' A' ' 706' ' ' TYR . 0.1 OUTLIER -75.59 -54.06 7.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.254 179.529 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 22.5 ttt85 -66.22 -34.12 77.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.202 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 3.0 ttt180 -67.79 -54.28 20.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.841 0.353 . . . . 0.0 110.983 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 717' ' ' LEU . . . . . 0.704 HD13 ' HB2' ' A' ' 632' ' ' HIS . 29.7 mt -64.62 -34.98 79.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.449 179.753 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 718' ' ' GLU . . . . . 0.62 ' HG3' HD13 ' A' ' 722' ' ' LEU . 28.3 tt0 -69.81 -53.81 16.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.405 179.599 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.48 -33.41 54.19 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.562 -179.703 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 720' ' ' GLU . . . . . 0.452 ' O ' ' HG2' ' A' ' 723' ' ' MET . 13.8 mt-10 -70.56 -55.73 8.18 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.036 0.446 . . . . 0.0 110.498 179.823 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 721' ' ' VAL . . . . . 0.551 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 41.4 t -61.66 -51.58 71.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.013 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 722' ' ' LEU . . . . . 0.64 HD11 ' CG ' ' A' ' 624' ' ' GLN . 9.0 mp -56.47 -38.56 71.87 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.921 -179.188 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 723' ' ' MET . . . . . 0.605 ' O ' HD12 ' A' ' 727' ' ' ILE . 16.1 ptp -74.67 -41.34 60.46 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.954 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 724' ' ' GLU . . . . . 0.432 ' N ' ' HG3' ' A' ' 723' ' ' MET . 1.6 mm-40 -56.87 -30.65 64.06 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.156 -179.846 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 725' ' ' LYS . . . . . 0.447 ' HD3' ' CZ2' ' A' ' 619' ' ' TRP . 15.0 pttt -86.19 -43.52 12.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.256 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -66.38 -51.55 55.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.082 -179.77 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 727' ' ' ILE . . . . . 0.632 ' O ' HG22 ' A' ' 727' ' ' ILE . 3.9 mp -87.83 11.66 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.667 -179.826 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 5.4 tt -52.64 -34.0 49.4 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.829 0.347 . . . . 0.0 111.142 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -83.57 -55.59 4.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.891 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 27.3 mtmm . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.27 -0.871 . . . . 0.0 110.932 -179.961 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 619' ' ' TRP . . . . . 0.507 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.1 OUTLIER . . . . . 0 CA--C 1.528 0.132 0 CA-C-O 120.618 0.246 . . . . 0.0 111.443 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 119.93 161.72 11.65 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.385 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -68.22 -36.19 17.16 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.499 2.133 . . . . 0.0 112.264 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 622' ' ' ASN . . . . . 0.48 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 43.1 m-80 -67.56 -35.86 79.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.856 179.904 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 623' ' ' VAL . . . . . 0.436 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 40.6 t -70.44 -38.48 74.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.618 179.527 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 624' ' ' GLN . . . . . 0.558 ' HG2' HD21 ' A' ' 722' ' ' LEU . 24.6 tp60 -68.17 -34.76 76.9 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.332 179.518 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 625' ' ' ARG . . . . . 0.517 ' O ' HD12 ' A' ' 629' ' ' ILE . 0.1 OUTLIER -63.21 -50.71 69.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.33 179.511 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 8.5 tt -67.35 -33.52 75.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.711 179.644 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -69.09 -46.87 66.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.209 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -59.07 -49.18 78.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.073 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 629' ' ' ILE . . . . . 0.716 HG21 HD23 ' A' ' 653' ' ' LEU . 7.3 mt -62.97 -35.46 71.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.109 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 5.7 ttpt -63.21 -47.85 80.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.069 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.31 -39.25 92.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.08 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 632' ' ' HIS . . . . . 0.791 ' HB2' HD13 ' A' ' 717' ' ' LEU . 78.5 t60 -70.73 -42.58 70.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.161 -179.876 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.587 HD13 ' SD ' ' A' ' 640' ' ' MET . 15.4 mt -58.13 -50.07 74.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.349 -179.559 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.62 -42.36 98.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.796 0.331 . . . . 0.0 110.671 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -73.59 -11.5 60.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.066 179.457 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 636' ' ' GLN . . . . . 0.4 ' CG ' ' CE1' ' A' ' 632' ' ' HIS . 15.6 mm-40 -98.62 -9.32 24.93 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.573 -179.799 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 119.06 -9.04 12.28 Favored Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.467 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 638' ' ' ILE . . . . . 0.648 ' N ' HD12 ' A' ' 638' ' ' ILE . 3.5 mp -100.69 104.65 16.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.748 0.309 . . . . 0.0 111.112 -179.62 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 2.4 m -76.68 113.44 14.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.89 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 640' ' ' MET . . . . . 0.587 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.9 mtp -129.09 31.7 4.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.97 -179.862 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.55 -28.53 69.93 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.043 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 642' ' ' GLU . . . . . 0.475 ' O ' HD12 ' A' ' 643' ' ' LEU . 27.4 mt-10 -79.86 -80.13 0.13 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.041 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 643' ' ' LEU . . . . . 0.475 HD12 ' O ' ' A' ' 642' ' ' GLU . 0.0 OUTLIER -177.54 140.14 0.43 Allowed Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.876 -179.972 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 644' ' ' PRO . . . . . 0.46 ' HB2' HD11 ' A' ' 651' ' ' LEU . 72.4 Cg_endo -77.02 147.36 26.61 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.588 2.192 . . . . 0.0 112.481 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 645' ' ' LEU . . . . . 0.65 HD12 ' HA ' ' A' ' 650' ' ' GLU . 5.1 tp -136.04 150.51 49.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.131 0.491 . . . . 0.0 110.965 179.675 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 646' ' ' ILE . . . . . 0.767 HD11 ' HA ' ' A' ' 695' ' ' LEU . 0.6 OUTLIER -147.85 132.19 9.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.701 179.249 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.31 41.79 62.86 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.317 -0.944 . . . . 0.0 112.345 -179.367 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 69.52 7.49 58.09 Favored Glycine 0 C--N 1.332 0.348 0 C-N-CA 121.0 -0.619 . . . . 0.0 113.779 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.7 m -132.97 163.76 28.48 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 117.358 0.579 . . . . 0.0 111.434 -179.268 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 650' ' ' GLU . . . . . 0.65 ' HA ' HD12 ' A' ' 645' ' ' LEU . 1.1 mp0 -79.66 144.54 33.65 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.708 179.809 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 651' ' ' LEU . . . . . 0.603 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -135.11 144.93 47.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.125 0.488 . . . . 0.0 111.357 -179.661 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.9 107.26 19.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.856 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 653' ' ' LEU . . . . . 0.716 HD23 HG21 ' A' ' 629' ' ' ILE . 7.2 mp -55.03 -40.21 69.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.959 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 654' ' ' ALA . . . . . 0.48 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -59.19 -43.45 92.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.98 179.842 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 5.6 t -72.16 -43.03 65.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.613 179.724 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 656' ' ' PHE . . . . . 0.435 ' CE2' ' HG ' ' A' ' 682' ' ' LEU . 0.3 OUTLIER -60.45 -46.37 90.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.754 179.801 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -60.6 -49.5 77.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.936 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.1 -43.22 99.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.946 -179.939 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 659' ' ' LEU . . . . . 0.469 HD22 ' O ' ' A' ' 678' ' ' LEU . 0.2 OUTLIER -57.55 -39.85 77.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.161 -179.87 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 660' ' ' ILE . . . . . 0.746 HD11 ' CH2' ' A' ' 675' ' ' TRP . 83.1 mt -69.01 -43.71 81.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.785 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.35 -43.35 94.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.051 -179.809 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -69.81 -13.73 62.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.355 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 1.2 ttm -94.27 21.18 7.24 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.29 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 95.44 -2.77 65.45 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.61 -0.805 . . . . 0.0 113.124 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 116.06 178.47 18.26 Favored Glycine 0 C--N 1.332 0.314 0 C-N-CA 120.539 -0.839 . . . . 0.0 112.446 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 666' ' ' MET . . . . . 0.705 ' HG2' HG21 ' A' ' 660' ' ' ILE . 0.0 OUTLIER -71.55 -30.85 66.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.862 0.363 . . . . 0.0 110.911 179.896 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 667' ' ' GLN . . . . . 0.401 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 19.0 pt20 -57.79 -48.74 78.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.458 -179.725 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 668' ' ' GLN . . . . . 0.415 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 11.6 mm100 -62.37 -52.41 63.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.864 0.364 . . . . 0.0 111.334 -179.637 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 669' ' ' VAL . . . . . 0.613 HG21 HG23 ' A' ' 660' ' ' ILE . 73.4 t -51.4 -55.78 7.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.936 -179.646 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 670' ' ' THR . . . . . 0.526 HG22 ' O ' ' A' ' 666' ' ' MET . 8.0 t -76.09 -50.03 15.83 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 -178.099 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 671' ' ' ASP . . . . . 0.477 ' N ' HG23 ' A' ' 670' ' ' THR . 5.7 t70 -61.6 -51.15 69.72 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -177.842 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 672' ' ' LEU . . . . . 0.415 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 8.8 mp -78.59 2.7 18.42 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 -178.915 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 48.77 86.6 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.994 0.426 . . . . 0.0 110.485 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -149.15 21.75 0.96 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.077 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 675' ' ' TRP . . . . . 1.072 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 36.2 m95 -59.02 -27.98 65.98 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.447 0.641 . . . . 0.0 110.093 179.706 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -56.54 -42.79 79.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.542 -179.661 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.58 -51.62 11.28 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.784 0.326 . . . . 0.0 111.419 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.972 HD22 ' HA ' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.49 -39.73 70.8 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 179.693 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 679' ' ' ALA . . . . . 0.845 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.94 -34.65 69.2 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.507 179.154 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -53.24 -48.5 68.16 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.433 179.628 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.14 -21.42 66.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.769 179.37 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 682' ' ' LEU . . . . . 0.541 HD23 ' O ' ' A' ' 678' ' ' LEU . 3.6 mm? -78.9 -1.41 35.0 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.496 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 683' ' ' ARG . . . . . 0.675 ' C ' HD12 ' A' ' 684' ' ' ILE . 3.5 mpt_? 68.5 71.81 0.29 Allowed 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.94 0.4 . . . . 0.0 111.489 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 684' ' ' ILE . . . . . 0.675 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.9 mp -123.97 136.02 26.99 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.273 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -63.25 125.33 15.52 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.418 2.079 . . . . 0.0 112.414 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.77 -16.05 63.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.102 179.839 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.57 -23.95 66.97 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.216 -179.787 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 688' ' ' ALA . . . . . 0.471 ' HB1' ' HB3' ' A' ' 691' ' ' ARG . . . -77.84 115.68 17.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.859 0.361 . . . . 0.0 110.769 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -76.18 -68.24 0.6 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.376 -179.456 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 56.9 m-20 -57.76 -11.67 2.41 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 691' ' ' ARG . . . . . 0.484 ' CG ' HD22 ' A' ' 692' ' ' LEU . 4.9 ptt-85 -50.32 -32.44 17.12 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.791 0.329 . . . . 0.0 111.049 -179.843 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 692' ' ' LEU . . . . . 0.484 HD22 ' CG ' ' A' ' 691' ' ' ARG . 2.9 mm? -68.17 -50.39 54.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.925 -179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.03 -37.31 69.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.039 179.89 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 694' ' ' LYS . . . . . 0.408 ' O ' ' HB2' ' A' ' 698' ' ' ALA . 1.3 mtpt -63.28 -37.83 88.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.243 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 1.072 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.5 OUTLIER -68.77 -44.26 74.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.484 179.74 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.449 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 31.8 tt0 -55.37 -47.7 75.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.748 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 71.1 mt-10 -77.11 -29.61 54.91 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.834 179.615 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 698' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' A' ' 694' ' ' LYS . . . -66.46 -38.03 86.44 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.46 -179.901 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 699' ' ' TYR . . . . . 0.499 ' CD2' ' CZ2' ' A' ' 675' ' ' TRP . 1.0 OUTLIER -85.92 -30.53 22.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.893 0.378 . . . . 0.0 110.496 179.862 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 700' ' ' CYS . . . . . 0.467 ' HA ' HD23 ' A' ' 704' ' ' LEU . 15.4 t -66.84 -30.51 70.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.644 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -99.49 -2.32 36.24 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.478 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 702' ' ' TYR . . . . . 0.405 ' CD1' ' O ' ' A' ' 698' ' ' ALA . 6.2 m-85 -117.68 -78.27 0.58 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.802 0.334 . . . . 0.0 111.214 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 75.7 mt -57.71 -43.74 85.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.464 -179.542 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.467 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.6 OUTLIER -55.08 -52.22 63.89 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.881 0.372 . . . . 0.0 111.008 -179.921 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 705' ' ' SER . . . . . 0.601 ' O ' HD13 ' A' ' 709' ' ' LEU . 59.7 p -54.37 -55.0 32.98 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.665 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 706' ' ' TYR . . . . . 0.442 ' HA ' ' CD2' ' A' ' 632' ' ' HIS . 9.7 t80 -46.9 -43.07 18.57 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.845 -179.571 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -94.03 0.02 55.72 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -179.48 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 22.6 t -79.19 -18.47 52.94 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -179.441 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 709' ' ' LEU . . . . . 0.601 HD13 ' O ' ' A' ' 705' ' ' SER . 0.0 OUTLIER -94.16 -173.92 3.23 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.831 0.348 . . . . 0.0 111.406 -179.815 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 710' ' ' SER . . . . . 0.407 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.3 OUTLIER -85.45 165.97 33.0 Favored Pre-proline 0 C--N 1.332 -0.181 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.048 -179.804 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 711' ' ' PRO . . . . . 0.407 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 18.0 Cg_endo -57.89 -18.93 37.12 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.625 2.217 . . . . 0.0 112.734 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -60.91 -54.27 47.06 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.913 0.387 . . . . 0.0 110.72 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 713' ' ' GLU . . . . . 0.419 ' HB2' ' HG ' ' A' ' 709' ' ' LEU . 18.6 mm-40 -60.41 -26.06 66.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.832 179.662 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -75.61 -53.86 7.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.114 179.255 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 6.2 mmm180 -64.65 -33.02 74.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.07 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 3.3 mtt180 -67.47 -54.28 21.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.867 0.365 . . . . 0.0 110.805 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 717' ' ' LEU . . . . . 0.791 HD13 ' HB2' ' A' ' 632' ' ' HIS . 25.9 mt -64.12 -37.47 87.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.478 179.63 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 718' ' ' GLU . . . . . 0.575 ' HG3' HD23 ' A' ' 722' ' ' LEU . 25.5 tt0 -67.63 -53.92 23.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.357 179.605 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.3 -34.76 48.16 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.497 -179.758 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 720' ' ' GLU . . . . . 0.408 ' O ' ' HG2' ' A' ' 723' ' ' MET . 1.2 mm-40 -67.69 -55.85 11.62 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.06 0.457 . . . . 0.0 110.279 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 721' ' ' VAL . . . . . 0.507 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 44.2 t -60.78 -50.96 78.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.638 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 722' ' ' LEU . . . . . 0.575 HD23 ' HG3' ' A' ' 718' ' ' GLU . 2.2 mm? -48.79 -46.39 41.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.907 -179.354 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 723' ' ' MET . . . . . 0.578 ' O ' HD12 ' A' ' 727' ' ' ILE . 18.0 ptp -73.99 -40.77 62.72 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.098 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -50.76 -41.53 56.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.759 -179.199 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 725' ' ' LYS . . . . . 0.519 ' NZ ' HD13 ' A' ' 722' ' ' LEU . 0.0 OUTLIER -83.23 -40.2 19.93 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.65 0.262 . . . . 0.0 111.271 -179.687 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -60.56 -52.99 62.84 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.968 0.413 . . . . 0.0 110.836 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 727' ' ' ILE . . . . . 0.616 ' O ' HG22 ' A' ' 727' ' ' ILE . 4.2 mp -89.82 11.62 2.0 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.558 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 6.6 tt -53.87 -42.47 68.64 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.847 0.356 . . . . 0.0 111.152 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -71.98 -70.64 0.32 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.962 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 730' ' ' LYS . . . . . 0.522 ' NZ ' HG23 ' A' ' 727' ' ' ILE . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.96 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 619' ' ' TRP . . . . . 0.572 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.1 OUTLIER . . . . . 0 CA--C 1.528 0.126 0 CA-C-O 120.627 0.251 . . . . 0.0 111.439 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 118.53 161.32 11.78 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.373 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -67.47 -39.81 11.76 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.497 2.131 . . . . 0.0 112.332 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 622' ' ' ASN . . . . . 0.474 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 11.6 p30 -65.08 -35.97 82.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.941 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 623' ' ' VAL . . . . . 0.429 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 42.1 t -67.81 -43.62 86.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.751 179.686 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 624' ' ' GLN . . . . . 0.524 ' HG2' HD11 ' A' ' 722' ' ' LEU . 40.9 tp60 -59.49 -42.68 92.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.526 179.686 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -58.66 -50.75 72.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.429 179.596 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 626' ' ' LEU . . . . . 0.485 HD23 ' O ' ' A' ' 626' ' ' LEU . 6.6 tt -65.7 -28.31 68.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.79 179.611 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 627' ' ' ALA . . . . . 0.411 ' HA ' ' HG2' ' A' ' 630' ' ' LYS . . . -71.4 -52.56 17.89 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.587 -179.775 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 29.5 p -60.84 -38.63 86.18 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.396 -179.533 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 629' ' ' ILE . . . . . 0.636 HG21 HD23 ' A' ' 653' ' ' LEU . 51.3 mt -66.72 -45.54 87.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.329 -179.728 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 630' ' ' LYS . . . . . 0.411 ' HG2' ' HA ' ' A' ' 627' ' ' ALA . 43.8 pttt -66.24 -33.89 76.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.722 0.296 . . . . 0.0 110.987 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 2.0 tttm -67.35 -46.8 72.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.014 0.435 . . . . 0.0 110.79 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 632' ' ' HIS . . . . . 0.704 ' HB2' HD13 ' A' ' 717' ' ' LEU . 86.6 t60 -67.28 -39.61 86.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.734 179.77 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.626 HD23 HD13 ' A' ' 638' ' ' ILE . 21.8 mt -57.82 -48.99 78.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.047 -179.903 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 634' ' ' ARG . . . . . 0.421 ' HG3' ' N ' ' A' ' 635' ' ' SER . 0.1 OUTLIER -63.16 -40.6 98.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.831 179.974 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 635' ' ' SER . . . . . 0.421 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 1.6 m -73.68 -19.93 60.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.219 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 23.6 tp60 -90.58 -7.45 52.79 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.677 -179.716 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 117.92 -13.12 12.98 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.478 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 638' ' ' ILE . . . . . 0.626 HD13 HD23 ' A' ' 633' ' ' LEU . 2.8 mp -94.38 104.59 15.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 120.608 0.242 . . . . 0.0 111.219 -179.716 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -77.56 121.34 23.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.837 0.351 . . . . 0.0 111.007 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 640' ' ' MET . . . . . 0.413 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.9 ttp -133.02 30.19 4.0 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.882 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -65.56 -33.99 77.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.872 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -69.59 -77.39 0.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.846 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 643' ' ' LEU . . . . . 0.445 ' O ' HD12 ' A' ' 643' ' ' LEU . 1.4 pp -179.98 136.68 0.28 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.873 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.81 121.01 7.0 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.499 2.132 . . . . 0.0 112.168 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 645' ' ' LEU . . . . . 0.633 HD12 ' HA ' ' A' ' 650' ' ' GLU . 5.0 tp -119.88 149.52 41.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.221 0.534 . . . . 0.0 111.287 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 646' ' ' ILE . . . . . 0.531 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.2 tt -144.83 130.15 14.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.45 178.987 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 647' ' ' GLY . . . . . 0.408 ' O ' ' NH1' ' A' ' 691' ' ' ARG . . . 51.91 47.0 54.82 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.269 -0.967 . . . . 0.0 112.086 -179.157 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 64.79 7.67 30.2 Favored Glycine 0 CA--C 1.521 0.421 0 C-N-CA 121.034 -0.603 . . . . 0.0 113.899 179.355 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 98.7 m -129.73 161.7 30.08 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 117.592 0.696 . . . . 0.0 111.516 -179.21 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 650' ' ' GLU . . . . . 0.633 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.8 OUTLIER -81.19 142.55 33.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.638 179.659 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 651' ' ' LEU . . . . . 0.62 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.9 144.72 47.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.041 0.448 . . . . 0.0 111.309 -179.737 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -94.16 109.18 20.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.782 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 653' ' ' LEU . . . . . 0.636 HD23 HG21 ' A' ' 629' ' ' ILE . 6.3 mp -56.67 -35.41 68.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.867 -180.0 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 654' ' ' ALA . . . . . 0.474 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -65.09 -46.81 79.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.958 179.806 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 46.9 t -70.58 -32.66 70.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.562 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 656' ' ' PHE . . . . . 0.484 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.2 OUTLIER -70.55 -46.07 64.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.81 179.881 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -60.14 -49.98 75.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.933 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 658' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 658' ' ' ARG . 0.9 OUTLIER -58.23 -43.99 88.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.963 -179.954 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.49 -48.01 80.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.253 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 660' ' ' ILE . . . . . 0.712 HG21 ' HG2' ' A' ' 666' ' ' MET . 23.3 mt -56.85 -45.73 83.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.916 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -64.68 -47.19 79.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.029 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -62.38 -16.75 56.51 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.441 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 663' ' ' MET . . . . . 0.413 ' CE ' ' HB3' ' A' ' 678' ' ' LEU . 0.1 OUTLIER -94.25 31.86 1.63 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.67 0.272 . . . . 0.0 111.295 -179.826 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 76.15 42.37 24.24 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.824 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 78.21 172.76 40.55 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.707 179.774 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 666' ' ' MET . . . . . 0.712 ' HG2' HG21 ' A' ' 660' ' ' ILE . 0.0 OUTLIER -73.13 -33.66 65.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.769 0.319 . . . . 0.0 111.322 179.963 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 16.0 pt20 -53.05 -43.76 66.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.322 -179.709 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 668' ' ' GLN . . . . . 0.452 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -64.66 -52.48 57.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.972 0.415 . . . . 0.0 110.707 -179.968 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 669' ' ' VAL . . . . . 0.63 HG21 HG23 ' A' ' 660' ' ' ILE . 90.6 t -49.28 -55.52 4.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.567 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 670' ' ' THR . . . . . 0.56 HG22 ' O ' ' A' ' 666' ' ' MET . 8.8 t -76.19 -51.47 12.05 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -178.467 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 671' ' ' ASP . . . . . 0.492 ' N ' HG23 ' A' ' 670' ' ' THR . 4.8 t70 -63.72 -51.3 65.59 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -177.658 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 672' ' ' LEU . . . . . 0.452 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 9.3 mp -77.3 3.34 13.23 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -179.039 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 49.02 86.35 0.03 OUTLIER 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.966 0.412 . . . . 0.0 110.509 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 21.0 mttt -146.2 21.91 1.37 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.261 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 675' ' ' TRP . . . . . 1.107 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 42.5 m95 -60.91 -28.57 69.02 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 121.401 0.619 . . . . 0.0 110.167 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 676' ' ' ASN . . . . . 0.637 ' CG ' HD11 ' A' ' 692' ' ' LEU . 49.4 m-80 -55.76 -43.84 77.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.534 -179.69 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 2.7 ttmm -77.09 -51.53 10.88 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 120.769 0.318 . . . . 0.0 111.4 -179.49 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.976 HD22 ' HA ' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -54.92 -41.25 70.75 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 179.65 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 679' ' ' ALA . . . . . 0.826 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.78 -34.51 69.48 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.766 179.283 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -53.17 -47.67 68.61 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.394 179.798 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 20.1 mtm -64.67 -21.57 66.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.764 179.383 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 682' ' ' LEU . . . . . 0.5 ' O ' ' HB2' ' A' ' 683' ' ' ARG . 3.2 mm? -80.11 -2.08 42.94 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.464 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 683' ' ' ARG . . . . . 0.815 ' C ' HD12 ' A' ' 684' ' ' ILE . 0.2 OUTLIER 72.34 71.76 0.15 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.925 0.393 . . . . 0.0 111.7 179.81 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 684' ' ' ILE . . . . . 0.815 HD12 ' C ' ' A' ' 683' ' ' ARG . 2.1 mp -129.22 139.95 37.2 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.062 179.406 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 685' ' ' PRO . . . . . 0.579 ' HD2' HG23 ' A' ' 684' ' ' ILE . 41.0 Cg_endo -66.83 124.81 12.79 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.303 2.002 . . . . 0.0 112.381 -179.745 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -19.18 63.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.19 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.34 -18.81 65.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.384 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 688' ' ' ALA . . . . . 0.43 ' CB ' ' NE ' ' A' ' 691' ' ' ARG . . . -84.47 107.08 16.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.863 0.363 . . . . 0.0 111.056 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -70.82 -67.77 0.48 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.06 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 45.1 m-20 -48.96 -20.93 0.57 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.972 -179.605 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 691' ' ' ARG . . . . . 0.43 ' NE ' ' CB ' ' A' ' 688' ' ' ALA . 1.4 ttm180 -46.37 -40.35 11.83 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.803 0.335 . . . . 0.0 111.297 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 692' ' ' LEU . . . . . 0.637 HD11 ' CG ' ' A' ' 676' ' ' ASN . 4.5 mm? -63.15 -46.46 87.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.183 -179.758 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.15 -38.67 69.13 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.774 0.321 . . . . 0.0 111.233 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 16.4 mmtt -63.54 -42.19 98.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.989 0.424 . . . . 0.0 110.339 179.758 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 1.107 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.2 OUTLIER -66.84 -40.67 88.04 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.404 179.646 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.425 ' O ' ' CD2' ' A' ' 699' ' ' TYR . 8.9 mt-30 -57.74 -44.98 86.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.788 179.733 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -77.31 -29.81 53.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.203 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 698' ' ' ALA . . . . . 0.4 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.28 -38.36 84.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.653 -179.704 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 699' ' ' TYR . . . . . 0.576 ' HB2' HD12 ' A' ' 703' ' ' LEU . 1.8 p90 -83.65 -37.23 23.1 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.864 0.364 . . . . 0.0 110.484 179.875 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 700' ' ' CYS . . . . . 0.562 ' HA ' HD23 ' A' ' 704' ' ' LEU . 6.8 t -62.18 -30.64 71.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.553 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -95.83 -3.49 45.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.32 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 702' ' ' TYR . . . . . 0.4 ' CD1' ' O ' ' A' ' 698' ' ' ALA . 10.1 m-85 -118.46 -78.53 0.58 Allowed 'General case' 0 CA--C 1.529 0.14 0 CA-C-O 120.849 0.356 . . . . 0.0 111.59 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 703' ' ' LEU . . . . . 0.576 HD12 ' HB2' ' A' ' 699' ' ' TYR . 23.2 mt -60.22 -43.85 95.68 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.966 -179.069 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.562 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.4 OUTLIER -47.9 -56.65 7.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.82 0.343 . . . . 0.0 111.647 -179.442 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 42.3 p -54.4 -48.57 71.43 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.405 -179.457 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 706' ' ' TYR . . . . . 0.596 ' O ' HD22 ' A' ' 709' ' ' LEU . 57.3 t80 -65.51 -29.21 69.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.529 -179.591 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -96.95 0.64 49.24 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -179.438 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 39.8 t -115.54 -12.77 11.6 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 111.771 0.285 . . . . 0.0 111.771 -179.53 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 709' ' ' LEU . . . . . 0.596 HD22 ' O ' ' A' ' 706' ' ' TYR . 0.3 OUTLIER -79.71 179.46 7.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.743 0.306 . . . . 0.0 111.04 -179.969 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -75.04 164.45 61.28 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.143 -179.85 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -68.87 -25.94 32.41 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.645 2.23 . . . . 0.0 112.203 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -50.55 -49.83 55.04 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.748 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 713' ' ' GLU . . . . . 0.585 ' HB2' HD11 ' A' ' 709' ' ' LEU . 1.5 mm-40 -59.89 -27.24 66.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.024 179.848 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 714' ' ' HIS . . . . . 0.555 ' CD2' HD21 ' A' ' 709' ' ' LEU . 12.8 m170 -76.14 -54.03 7.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.501 179.484 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.16 -44.25 97.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.437 -179.614 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 20.8 mtp85 -66.19 -54.18 28.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.223 -179.537 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 717' ' ' LEU . . . . . 0.704 HD13 ' HB2' ' A' ' 632' ' ' HIS . 53.1 mt -62.64 -39.54 94.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.674 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -67.33 -54.03 24.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.33 179.652 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -50.53 -34.7 26.39 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.337 -179.791 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 720' ' ' GLU . . . . . 0.429 ' O ' ' HG2' ' A' ' 723' ' ' MET . 0.5 OUTLIER -69.39 -55.43 10.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.005 0.431 . . . . 0.0 110.561 179.626 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 721' ' ' VAL . . . . . 0.634 HG23 ' O ' ' A' ' 717' ' ' LEU . 16.8 t -62.03 -54.94 27.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.156 -179.859 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 722' ' ' LEU . . . . . 0.524 HD11 ' HG2' ' A' ' 624' ' ' GLN . 1.2 mp -50.51 -44.18 56.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.009 -179.266 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 723' ' ' MET . . . . . 0.622 ' O ' HD12 ' A' ' 727' ' ' ILE . 16.9 ptp -71.44 -40.31 70.47 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.496 -0.481 . . . . 0.0 110.024 179.719 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 724' ' ' GLU . . . . . 0.4 ' N ' ' HG3' ' A' ' 723' ' ' MET . 5.6 mm-40 -57.49 -31.58 66.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.381 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 725' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.14 -43.14 13.28 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.404 -179.67 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -66.52 -48.93 68.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.834 0.349 . . . . 0.0 111.193 -179.699 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 727' ' ' ILE . . . . . 0.631 ' O ' HG22 ' A' ' 727' ' ' ILE . 3.9 mp -88.96 11.67 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.534 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 5.6 tt -57.38 -36.41 71.21 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.789 0.328 . . . . 0.0 111.028 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -64.57 -68.65 0.34 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.934 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.895 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 619' ' ' TRP . . . . . 0.541 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.117 0 CA-C-O 120.684 0.278 . . . . 0.0 111.258 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 123.44 163.25 11.71 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.443 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -66.75 -39.11 15.93 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.542 2.162 . . . . 0.0 112.118 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 622' ' ' ASN . . . . . 0.668 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 6.0 p30 -63.15 -39.25 94.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.888 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 623' ' ' VAL . . . . . 0.465 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 38.8 t -73.29 -35.32 46.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.781 179.701 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 624' ' ' GLN . . . . . 0.656 ' CG ' HD11 ' A' ' 722' ' ' LEU . 0.7 OUTLIER -60.2 -42.43 95.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.689 179.707 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 4.8 tpp180 -69.32 -48.54 61.17 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.72 179.781 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 8.1 tt -61.45 -30.74 70.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.828 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 627' ' ' ALA . . . . . 0.479 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -72.02 -50.63 26.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.201 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -57.2 -46.94 82.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.999 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 629' ' ' ILE . . . . . 0.655 HG21 HD23 ' A' ' 653' ' ' LEU . 12.6 mt -64.47 -39.2 84.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.91 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 630' ' ' LYS . . . . . 0.487 ' HA ' HD12 ' A' ' 633' ' ' LEU . 10.6 ttpt -60.77 -49.73 76.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.738 179.89 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 9.5 tttm -59.5 -38.17 80.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.75 179.854 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 632' ' ' HIS . . . . . 0.578 ' CE1' ' HG3' ' A' ' 636' ' ' GLN . 28.7 t-80 -70.08 -44.25 69.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.83 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 633' ' ' LEU . . . . . 0.662 HD13 ' SD ' ' A' ' 640' ' ' MET . 10.6 mt -55.89 -50.2 71.3 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.369 -179.552 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.92 -41.8 97.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.765 0.317 . . . . 0.0 110.75 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 6.7 t -73.5 -11.5 60.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.958 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 636' ' ' GLN . . . . . 0.578 ' HG3' ' CE1' ' A' ' 632' ' ' HIS . 35.5 mm-40 -99.04 -10.59 22.41 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.551 -179.838 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 117.12 -0.83 19.31 Favored Glycine 0 C--N 1.332 0.34 0 C-N-CA 120.581 -0.819 . . . . 0.0 112.623 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 638' ' ' ILE . . . . . 0.415 HG21 ' CE2' ' A' ' 702' ' ' TYR . 13.8 mt -108.44 109.94 30.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 120.712 0.292 . . . . 0.0 111.327 -179.47 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 5.1 m -83.81 115.06 22.05 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.861 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 640' ' ' MET . . . . . 0.662 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.6 mtp -125.38 30.73 5.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.964 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -64.02 -30.76 71.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.956 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -74.51 -80.09 0.08 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.957 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 643' ' ' LEU . . . . . 0.417 HD12 ' HA ' ' A' ' 643' ' ' LEU . 8.7 tp -179.08 132.09 0.27 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.845 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 644' ' ' PRO . . . . . 0.54 ' HB2' HD11 ' A' ' 651' ' ' LEU . 66.2 Cg_endo -74.49 137.86 23.55 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.481 2.121 . . . . 0.0 112.279 179.937 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 645' ' ' LEU . . . . . 0.636 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.8 tp -129.19 151.6 49.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.187 0.518 . . . . 0.0 111.236 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 646' ' ' ILE . . . . . 0.665 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.3 tt -149.64 133.51 8.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.873 179.086 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 54.64 38.35 63.46 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.342 -0.933 . . . . 0.0 112.221 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.05 7.92 63.59 Favored Glycine 0 C--N 1.333 0.377 0 C-N-CA 120.924 -0.655 . . . . 0.0 113.595 179.353 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 2.1 m -133.73 163.89 28.45 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 117.315 0.557 . . . . 0.0 111.424 -179.282 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 650' ' ' GLU . . . . . 0.636 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.3 OUTLIER -78.28 145.52 35.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.669 179.679 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 651' ' ' LEU . . . . . 0.609 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.79 145.0 47.97 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.085 0.469 . . . . 0.0 111.466 -179.615 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -96.85 109.25 21.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.725 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 653' ' ' LEU . . . . . 0.655 HD23 HG21 ' A' ' 629' ' ' ILE . 8.2 mp -53.85 -35.29 61.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.949 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 654' ' ' ALA . . . . . 0.668 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -65.02 -43.57 92.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.007 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 49.6 t -72.87 -33.6 66.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.655 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 656' ' ' PHE . . . . . 0.44 ' CE2' ' HG ' ' A' ' 682' ' ' LEU . 0.3 OUTLIER -71.47 -47.92 52.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.805 179.891 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -59.45 -49.16 78.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.893 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 22.2 tpp180 -59.66 -41.93 91.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.868 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 659' ' ' LEU . . . . . 0.752 HD22 ' CD2' ' A' ' 682' ' ' LEU . 0.1 OUTLIER -58.5 -49.18 78.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.103 -179.825 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 660' ' ' ILE . . . . . 0.685 HG23 HG21 ' A' ' 669' ' ' VAL . 27.9 mt -56.79 -45.66 83.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.791 0.329 . . . . 0.0 110.819 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -62.73 -42.31 99.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.884 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -72.11 -11.02 60.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.307 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 663' ' ' MET . . . . . 0.525 ' HE1' ' HB3' ' A' ' 678' ' ' LEU . 0.6 OUTLIER -96.49 32.3 2.05 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.806 0.336 . . . . 0.0 111.047 -179.876 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 75.06 36.55 45.93 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.602 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 665' ' ' GLY . . . . . 0.426 ' O ' HG23 ' A' ' 669' ' ' VAL . . . 82.49 171.23 46.46 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.53 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 666' ' ' MET . . . . . 0.707 ' O ' HG22 ' A' ' 670' ' ' THR . 0.0 OUTLIER -72.49 -32.82 66.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.839 0.352 . . . . 0.0 111.035 179.962 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 27.5 tt0 -54.13 -48.88 70.32 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.193 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 668' ' ' GLN . . . . . 0.447 ' HG3' HD13 ' A' ' 672' ' ' LEU . 0.1 OUTLIER -63.5 -50.63 68.88 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.827 0.346 . . . . 0.0 111.321 -179.632 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 669' ' ' VAL . . . . . 0.685 HG21 HG23 ' A' ' 660' ' ' ILE . 57.2 t -49.04 -52.66 9.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.917 0.389 . . . . 0.0 111.159 179.881 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 670' ' ' THR . . . . . 0.707 HG22 ' O ' ' A' ' 666' ' ' MET . 7.6 t -76.3 -53.92 7.51 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -178.853 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 671' ' ' ASP . . . . . 0.468 ' N ' HG23 ' A' ' 670' ' ' THR . 23.6 m-20 -60.2 -51.41 69.68 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 -177.751 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 672' ' ' LEU . . . . . 0.447 HD13 ' HG3' ' A' ' 668' ' ' GLN . 6.9 mp -75.96 1.66 14.69 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -178.961 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 49.54 82.17 0.05 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.999 0.428 . . . . 0.0 110.297 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 11.1 ttpt -142.19 23.4 2.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.272 -179.517 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 675' ' ' TRP . . . . . 1.1 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 38.5 m95 -62.49 -28.54 69.9 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 121.361 0.6 . . . . 0.0 110.21 179.809 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -56.69 -44.41 81.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.49 -179.643 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.11 -51.51 12.07 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 120.814 0.34 . . . . 0.0 111.267 -179.602 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 678' ' ' LEU . . . . . 0.98 HD22 ' HA ' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.21 -40.44 70.79 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 179.523 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 679' ' ' ALA . . . . . 0.839 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.64 -33.9 69.32 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.59 179.188 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -53.54 -48.73 68.81 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.484 179.638 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 2.4 mtm -64.12 -20.02 65.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.968 179.463 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 682' ' ' LEU . . . . . 0.752 ' CD2' HD22 ' A' ' 659' ' ' LEU . 3.7 mm? -81.85 -0.98 45.98 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.513 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 683' ' ' ARG . . . . . 0.647 ' C ' HD12 ' A' ' 684' ' ' ILE . 5.1 mmm180 66.84 71.88 0.37 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.895 0.379 . . . . 0.0 111.603 179.729 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 684' ' ' ILE . . . . . 0.647 HD12 ' C ' ' A' ' 683' ' ' ARG . 2.1 mp -123.24 139.06 30.97 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.368 179.52 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 685' ' ' PRO . . . . . 0.507 ' HD2' HG23 ' A' ' 684' ' ' ILE . 33.0 Cg_endo -64.79 123.61 11.92 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.422 2.082 . . . . 0.0 112.454 -179.701 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 4.1 mmmt -69.92 -20.47 63.35 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.212 179.799 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 19.1 p -65.52 -23.86 66.98 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.555 -179.546 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 688' ' ' ALA . . . . . 0.458 ' HB3' ' HB3' ' A' ' 691' ' ' ARG . . . -69.14 110.77 4.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.756 0.312 . . . . 0.0 111.323 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -83.38 4.68 26.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.527 179.775 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -119.33 -17.79 8.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.904 0.383 . . . . 0.0 110.674 179.295 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 691' ' ' ARG . . . . . 0.641 ' CG ' HD22 ' A' ' 692' ' ' LEU . 8.3 ptt85 -49.81 -36.47 26.61 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.542 -179.715 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 692' ' ' LEU . . . . . 0.641 HD22 ' CG ' ' A' ' 691' ' ' ARG . 2.6 mm? -68.77 -52.64 28.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.623 -179.25 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.99 -39.65 69.1 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.838 0.352 . . . . 0.0 111.288 -179.731 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -61.86 -40.0 93.83 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.094 0.473 . . . . 0.0 110.15 179.558 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 695' ' ' LEU . . . . . 1.1 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 2.7 tp -65.57 -45.34 83.67 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.53 179.57 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 696' ' ' GLN . . . . . 0.464 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 9.8 mt-30 -55.43 -50.85 68.74 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.05 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -74.14 -29.67 61.92 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.01 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 698' ' ' ALA . . . . . 0.416 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.89 -39.29 83.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.602 -179.765 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 699' ' ' TYR . . . . . 0.517 ' CD2' ' CZ2' ' A' ' 675' ' ' TRP . 0.7 OUTLIER -86.0 -31.25 22.14 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.032 0.444 . . . . 0.0 110.485 179.84 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 700' ' ' CYS . . . . . 0.442 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 43.8 t -66.92 -30.52 70.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.852 179.89 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.14 -1.16 37.39 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.567 -179.719 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 702' ' ' TYR . . . . . 0.455 ' CD2' ' CD2' ' A' ' 633' ' ' LEU . 5.8 m-85 -119.06 -79.08 0.59 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.821 0.343 . . . . 0.0 111.326 -179.8 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 703' ' ' LEU . . . . . 0.627 ' CD2' HD12 ' A' ' 660' ' ' ILE . 3.8 tp -56.44 -43.06 79.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.571 -179.395 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 704' ' ' LEU . . . . . 0.442 ' HB2' ' O ' ' A' ' 700' ' ' CYS . 1.1 mm? -53.01 -37.17 61.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.893 0.378 . . . . 0.0 111.164 -179.771 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 3.9 m -65.63 -54.94 20.68 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.796 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 706' ' ' TYR . . . . . 0.625 ' O ' HD22 ' A' ' 709' ' ' LEU . 21.0 t80 -60.35 -29.19 68.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.738 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 4.8 p30 -96.91 -7.21 33.88 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -179.332 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 708' ' ' SER . . . . . 0.402 ' CB ' ' O ' ' A' ' 704' ' ' LEU . 41.8 m -102.89 -22.55 13.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.708 0.29 . . . . 0.0 111.363 -179.845 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 709' ' ' LEU . . . . . 0.658 HD23 ' O ' ' A' ' 709' ' ' LEU . 0.2 OUTLIER -71.43 170.97 12.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.772 0.32 . . . . 0.0 111.005 -179.941 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.63 166.75 41.38 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.168 -179.687 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 711' ' ' PRO . . . . . 0.421 ' O ' ' HB2' ' A' ' 714' ' ' HIS . 38.0 Cg_endo -66.53 -32.03 40.25 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.57 2.18 . . . . 0.0 112.045 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -48.86 -48.69 41.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.578 179.786 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 713' ' ' GLU . . . . . 0.437 ' HB2' ' CD1' ' A' ' 709' ' ' LEU . 6.2 mm-40 -59.71 -26.2 65.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.111 179.633 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 714' ' ' HIS . . . . . 0.429 ' HE1' ' O ' ' A' ' 706' ' ' TYR . 3.0 m80 -75.87 -54.05 7.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.387 179.665 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.77 -42.43 99.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.282 -179.657 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -66.37 -54.25 26.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.821 0.343 . . . . 0.0 111.16 -179.598 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 717' ' ' LEU . . . . . 0.539 ' O ' HG23 ' A' ' 721' ' ' VAL . 73.4 mt -63.64 -39.91 95.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.723 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 718' ' ' GLU . . . . . 0.605 ' HG3' HD13 ' A' ' 722' ' ' LEU . 23.4 tt0 -67.52 -54.32 21.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.302 179.825 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -50.72 -34.94 28.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.358 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 720' ' ' GLU . . . . . 0.434 ' O ' ' HG2' ' A' ' 723' ' ' MET . 2.9 mm-40 -70.51 -55.42 8.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.996 0.427 . . . . 0.0 110.723 179.842 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 721' ' ' VAL . . . . . 0.541 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 38.6 t -62.48 -54.87 28.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.112 -179.662 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 722' ' ' LEU . . . . . 0.656 HD11 ' CG ' ' A' ' 624' ' ' GLN . 3.6 mp -53.57 -40.04 65.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.872 -179.378 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 723' ' ' MET . . . . . 0.672 ' O ' HD12 ' A' ' 727' ' ' ILE . 9.5 ptp -74.59 -41.21 60.88 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 120.407 -0.517 . . . . 0.0 109.949 179.475 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 724' ' ' GLU . . . . . 0.409 ' N ' ' HG3' ' A' ' 723' ' ' MET . 4.2 mm-40 -55.61 -42.74 75.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.835 -179.414 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 725' ' ' LYS . . . . . 0.43 ' HB3' ' CZ3' ' A' ' 619' ' ' TRP . 0.0 OUTLIER -79.12 -36.66 40.27 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.661 -179.29 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -69.39 -53.27 20.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.837 0.351 . . . . 0.0 111.044 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 727' ' ' ILE . . . . . 0.672 HD12 ' O ' ' A' ' 723' ' ' MET . 3.7 mp -88.51 11.65 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.621 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 1.9 tt -53.98 -47.4 71.42 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.798 0.332 . . . . 0.0 111.121 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -73.21 -53.45 10.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.949 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 24.3 mtmt . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.896 179.968 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.236 0 N-CA-C 112.494 -0.242 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.0 -28.39 24.16 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.641 2.228 . . . . 0.0 112.287 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 11.3 mt -80.75 179.02 8.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.924 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 94.78 62.0 1.03 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.502 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -98.85 31.84 2.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.783 0.325 . . . . 0.0 110.928 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 23.3 mt -67.27 170.72 6.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.872 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 139.18 -52.85 0.71 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.517 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.89 -143.85 0.39 Allowed 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 110.445 -0.206 . . . . 0.0 110.445 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 6.5 mtt-85 -71.63 137.36 47.86 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.95 0.405 . . . . 0.0 111.169 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 619' ' ' TRP . . . . . 0.491 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.0 OUTLIER -82.66 -14.66 54.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.366 179.902 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 122.11 163.76 12.0 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.507 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -67.61 -40.76 9.59 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.597 2.198 . . . . 0.0 112.26 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 -62.27 -36.42 82.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.854 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 623' ' ' VAL . . . . . 0.481 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 43.0 t -75.77 -39.63 38.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.817 179.693 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 624' ' ' GLN . . . . . 0.523 ' CG ' HD11 ' A' ' 722' ' ' LEU . 3.8 tm0? -64.76 -40.53 95.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.669 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.24 -49.97 65.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.736 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 626' ' ' LEU . . . . . 0.619 HD23 ' O ' ' A' ' 626' ' ' LEU . 7.1 tt -63.48 -32.13 73.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.914 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -71.49 -50.16 34.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.317 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.21 -46.46 82.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.157 -179.727 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 30.3 mt -64.24 -40.85 90.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.056 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 7.4 ttpt -62.82 -47.24 84.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.999 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 1.3 tttm -59.1 -40.47 85.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.258 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 632' ' ' HIS . . . . . 0.692 ' NE2' HD21 ' A' ' 709' ' ' LEU . 31.9 t-80 -72.78 -42.1 64.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.085 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.67 HD13 ' SD ' ' A' ' 640' ' ' MET . 20.2 mt -55.96 -49.85 72.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.355 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 634' ' ' ARG . . . . . 0.41 ' HA ' ' O ' ' A' ' 638' ' ' ILE . 1.0 OUTLIER -68.34 -39.48 81.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.847 179.988 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 1.3 m -73.68 -11.58 60.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.353 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 2.8 tp60 -100.32 -4.62 28.83 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 111.733 0.271 . . . . 0.0 111.733 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 113.23 -0.44 25.27 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.493 -0.86 . . . . 0.0 112.593 179.453 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 638' ' ' ILE . . . . . 0.41 ' O ' ' HA ' ' A' ' 634' ' ' ARG . 13.7 mt -108.63 104.68 17.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-O 120.666 0.27 . . . . 0.0 111.202 -179.421 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 1.6 m -77.42 116.8 18.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.876 0.369 . . . . 0.0 110.94 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 640' ' ' MET . . . . . 0.67 ' SD ' HD13 ' A' ' 633' ' ' LEU . 2.1 ttp -130.49 30.7 4.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.838 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -66.81 -39.31 87.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.01 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 642' ' ' GLU . . . . . 0.532 ' O ' HD12 ' A' ' 643' ' ' LEU . 6.6 mm-40 -63.57 -79.9 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.935 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 643' ' ' LEU . . . . . 0.532 HD12 ' O ' ' A' ' 642' ' ' GLU . 0.1 OUTLIER -178.37 132.34 0.3 Allowed Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.803 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 644' ' ' PRO . . . . . 0.548 ' HB2' HD11 ' A' ' 651' ' ' LEU . 74.4 Cg_endo -75.23 142.76 27.57 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.488 2.125 . . . . 0.0 112.266 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 645' ' ' LEU . . . . . 0.658 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.8 tp -133.84 151.93 51.7 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.211 0.529 . . . . 0.0 111.211 179.795 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 646' ' ' ILE . . . . . 0.742 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.1 tt -149.8 133.89 8.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.905 179.107 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.41 38.55 57.8 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.363 -0.922 . . . . 0.0 112.097 -179.335 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.2 7.88 64.17 Favored Glycine 0 CA--C 1.52 0.385 0 C-N-CA 120.94 -0.648 . . . . 0.0 113.584 179.535 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -132.67 162.55 31.1 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 117.311 0.556 . . . . 0.0 111.4 -179.307 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 650' ' ' GLU . . . . . 0.658 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.7 OUTLIER -77.78 145.21 36.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.793 179.888 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 651' ' ' LEU . . . . . 0.638 HD23 ' HD2' ' A' ' 656' ' ' PHE . 0.0 OUTLIER -135.22 145.37 47.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.373 -179.695 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -99.89 113.33 25.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.944 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -52.37 -39.44 60.79 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.127 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -63.69 -43.88 95.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.03 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 10.6 t -70.07 -38.31 75.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.746 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 656' ' ' PHE . . . . . 0.638 ' HD2' HD23 ' A' ' 651' ' ' LEU . 0.1 OUTLIER -68.7 -46.3 69.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.794 179.943 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 43.9 t80 -57.46 -48.79 78.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.893 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -60.66 -40.73 93.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.955 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 659' ' ' LEU . . . . . 0.453 HD11 ' CE ' ' A' ' 681' ' ' MET . 0.2 OUTLIER -57.95 -51.67 68.69 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.163 -179.752 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 660' ' ' ILE . . . . . 0.624 HG23 HG21 ' A' ' 669' ' ' VAL . 33.3 mt -56.75 -46.14 83.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 120.821 0.343 . . . . 0.0 111.127 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 23.6 t30 -61.43 -39.82 92.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.078 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -68.26 -13.85 62.56 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.51 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.46 36.61 1.24 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.797 0.332 . . . . 0.0 111.099 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 67.92 25.88 74.12 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.644 -0.788 . . . . 0.0 112.424 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 96.4 170.07 34.57 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.541 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 666' ' ' MET . . . . . 0.521 ' O ' HG22 ' A' ' 670' ' ' THR . 10.0 tpt -65.6 -37.74 87.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.727 0.298 . . . . 0.0 111.217 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 667' ' ' GLN . . . . . 0.432 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 4.9 pt20 -50.62 -43.69 56.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.449 -179.665 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 668' ' ' GLN . . . . . 0.419 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -66.96 -52.59 40.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.815 0.341 . . . . 0.0 110.973 -179.9 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 669' ' ' VAL . . . . . 0.624 HG21 HG23 ' A' ' 660' ' ' ILE . 55.4 t -49.19 -54.65 5.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.461 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 670' ' ' THR . . . . . 0.521 HG22 ' O ' ' A' ' 666' ' ' MET . 14.0 t -76.15 -52.51 9.94 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -178.682 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 671' ' ' ASP . . . . . 0.499 ' N ' HG23 ' A' ' 670' ' ' THR . 19.0 t70 -59.45 -51.15 71.12 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -177.879 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 672' ' ' LEU . . . . . 0.419 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 4.5 mm? -76.42 0.87 18.08 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 3.1 mtpm? 49.71 81.77 0.06 Allowed 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.017 0.437 . . . . 0.0 110.363 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 3.9 mttm -144.48 20.18 1.7 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.193 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 675' ' ' TRP . . . . . 1.147 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 26.0 m95 -55.75 -29.85 60.25 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.324 0.583 . . . . 0.0 110.236 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 -55.88 -41.7 74.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.843 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.69 -51.76 10.07 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.173 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 1.057 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -58.09 -40.51 81.32 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 179.691 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 679' ' ' ALA . . . . . 0.801 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -70.27 -36.13 74.22 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.554 179.184 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -53.36 -48.42 68.57 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.403 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 681' ' ' MET . . . . . 0.453 ' CE ' HD11 ' A' ' 659' ' ' LEU . 31.6 mtm -64.08 -23.07 67.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.844 179.492 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 682' ' ' LEU . . . . . 0.471 HD23 ' O ' ' A' ' 678' ' ' LEU . 3.4 mm? -78.21 -3.12 41.07 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.472 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 683' ' ' ARG . . . . . 0.695 ' C ' HD12 ' A' ' 684' ' ' ILE . 3.4 mtp85 70.4 71.74 0.21 Allowed 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.915 0.388 . . . . 0.0 111.592 179.6 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 684' ' ' ILE . . . . . 0.695 HD12 ' C ' ' A' ' 683' ' ' ARG . 2.2 mp -123.66 141.37 36.39 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.223 179.459 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 685' ' ' PRO . . . . . 0.651 ' HD2' HG23 ' A' ' 684' ' ' ILE . 44.2 Cg_endo -69.07 120.94 7.77 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.543 2.162 . . . . 0.0 112.752 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.01 -21.59 63.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.103 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.46 -22.33 66.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.601 -179.414 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 688' ' ' ALA . . . . . 0.74 ' HB3' ' HG2' ' A' ' 691' ' ' ARG . . . -72.24 116.24 12.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.929 0.395 . . . . 0.0 111.218 -179.814 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -83.44 4.9 25.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.396 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -121.88 -15.18 7.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.087 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 691' ' ' ARG . . . . . 0.809 ' HG3' HD22 ' A' ' 692' ' ' LEU . 0.5 OUTLIER -55.84 -32.8 63.92 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.088 -179.639 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 692' ' ' LEU . . . . . 0.809 HD22 ' HG3' ' A' ' 691' ' ' ARG . 3.3 mm? -70.58 -54.12 13.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.462 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.23 -37.66 72.0 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.417 -179.544 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 2.8 mmmt -64.28 -38.63 91.73 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.089 0.471 . . . . 0.0 109.896 179.375 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 1.147 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 4.3 tp -64.9 -47.12 78.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.812 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.404 ' HA ' ' CD2' ' A' ' 699' ' ' TYR . 24.8 mt-30 -55.21 -49.01 73.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.206 -179.669 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -76.02 -29.65 58.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.206 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 698' ' ' ALA . . . . . 0.406 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.26 -36.83 82.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.879 -179.585 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 699' ' ' TYR . . . . . 0.504 ' CE1' ' HE2' ' A' ' 666' ' ' MET . 1.5 p90 -85.63 -36.31 20.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.973 0.416 . . . . 0.0 110.495 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 700' ' ' CYS . . . . . . . . . . . . . 5.6 t -62.95 -30.59 71.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.538 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -96.77 -5.32 38.8 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.453 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 702' ' ' TYR . . . . . 0.411 ' CD2' HD21 ' A' ' 633' ' ' LEU . 6.1 m-85 -119.11 -78.21 0.58 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.851 0.358 . . . . 0.0 111.254 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 703' ' ' LEU . . . . . 0.474 ' HA ' HD13 ' A' ' 703' ' ' LEU . 3.9 mm? -55.34 -42.62 74.07 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.47 -179.506 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.456 HD23 ' CE1' ' A' ' 699' ' ' TYR . 1.1 mm? -61.64 -56.03 24.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.144 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.65 -55.27 31.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.961 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 706' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -59.59 -51.11 71.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.017 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -58.8 -20.57 51.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.282 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 1.4 m -84.29 -16.3 43.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.974 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 709' ' ' LEU . . . . . 0.692 HD21 ' NE2' ' A' ' 632' ' ' HIS . 62.3 mt -50.63 141.37 12.77 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.501 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 710' ' ' SER . . . . . 0.454 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.6 OUTLIER -75.92 168.25 29.5 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.597 179.742 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 711' ' ' PRO . . . . . 0.454 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 10.7 Cg_endo -54.13 -25.88 39.42 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.53 2.154 . . . . 0.0 112.376 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -69.98 -53.97 15.37 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.019 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 713' ' ' GLU . . . . . 0.519 ' HB2' ' HB3' ' A' ' 709' ' ' LEU . 62.1 mm-40 -59.73 -26.22 65.46 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.907 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 8.1 m-70 -75.89 -54.16 7.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.355 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.28 -41.77 99.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.344 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 2.8 mmm-85 -65.49 -54.2 31.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.858 0.361 . . . . 0.0 111.29 -179.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 717' ' ' LEU . . . . . 0.482 HD13 ' HB2' ' A' ' 632' ' ' HIS . 55.0 mt -65.44 -40.63 93.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.015 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 718' ' ' GLU . . . . . 0.74 ' HG2' HD22 ' A' ' 722' ' ' LEU . 30.8 tt0 -67.99 -54.32 19.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.639 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.98 -34.55 56.52 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.465 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 720' ' ' GLU . . . . . 0.43 ' O ' ' HG2' ' A' ' 723' ' ' MET . 0.4 OUTLIER -67.51 -55.9 11.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.021 0.438 . . . . 0.0 110.494 179.832 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 721' ' ' VAL . . . . . 0.491 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 33.3 t -64.06 -52.92 50.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.156 -179.637 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 722' ' ' LEU . . . . . 0.74 HD22 ' HG2' ' A' ' 718' ' ' GLU . 5.1 mp -49.03 -44.8 41.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.918 -179.397 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 723' ' ' MET . . . . . 0.527 ' HB2' HD13 ' A' ' 727' ' ' ILE . 18.8 ptp -72.19 -40.04 68.19 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.239 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 724' ' ' GLU . . . . . 0.409 ' N ' ' HG3' ' A' ' 723' ' ' MET . 5.5 mm-40 -52.64 -34.84 53.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.436 -179.646 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 725' ' ' LYS . . . . . 0.455 ' HD3' ' CE2' ' A' ' 619' ' ' TRP . 4.4 pttm -86.09 -40.29 15.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.455 -179.645 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -66.14 -52.59 46.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.383 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 727' ' ' ILE . . . . . 0.662 ' O ' HG22 ' A' ' 727' ' ' ILE . 4.6 mp -87.09 11.55 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.679 -179.746 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 728' ' ' LEU . . . . . 0.43 ' O ' HD23 ' A' ' 728' ' ' LEU . 4.9 tt -57.86 -32.57 67.78 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.881 0.372 . . . . 0.0 110.925 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -65.63 -68.8 0.34 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.927 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.874 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.21 0 N-CA-C 112.581 -0.208 . . . . 0.0 112.581 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -53.13 -42.46 64.61 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.529 2.153 . . . . 0.0 112.287 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -88.27 162.64 16.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.887 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . -135.02 68.08 0.54 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.438 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 67.8 m 61.75 69.17 0.65 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.876 0.369 . . . . 0.0 110.803 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 28.9 mt -91.53 169.04 11.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.002 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 123.14 -74.49 0.38 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.456 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 3.2 mtp180 59.33 134.59 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 121.241 0.543 . . . . 0.0 111.441 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.43 140.11 30.25 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.82 179.935 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 619' ' ' TRP . . . . . 0.444 ' CE2' ' HD2' ' A' ' 725' ' ' LYS . 0.1 OUTLIER -72.41 -8.83 57.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.369 179.959 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 119.78 159.04 10.79 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.47 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -66.99 -40.9 10.9 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.578 2.186 . . . . 0.0 112.013 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 622' ' ' ASN . . . . . 0.656 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 11.9 m120 -64.61 -34.91 79.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.72 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 623' ' ' VAL . . . . . 0.417 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 38.6 t -72.98 -39.98 58.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.89 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 624' ' ' GLN . . . . . 0.567 ' CG ' HD11 ' A' ' 722' ' ' LEU . 3.1 tm0? -60.63 -41.18 94.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.709 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 6.6 mpt_? -67.0 -50.83 60.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.824 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 8.3 tt -62.01 -29.97 70.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.041 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 627' ' ' ALA . . . . . 0.411 ' HA ' ' HG2' ' A' ' 630' ' ' LYS . . . -70.98 -45.07 64.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.434 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -65.13 -38.85 91.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.262 -179.668 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 38.8 mt -66.8 -46.32 85.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.497 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 630' ' ' LYS . . . . . 0.456 ' HG3' ' N ' ' A' ' 631' ' ' LYS . 19.2 pttt -66.09 -32.6 74.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.798 0.332 . . . . 0.0 110.996 -179.819 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 631' ' ' LYS . . . . . 0.456 ' N ' ' HG3' ' A' ' 630' ' ' LYS . 0.0 OUTLIER -66.39 -44.76 82.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.991 0.424 . . . . 0.0 110.735 179.838 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 632' ' ' HIS . . . . . 0.847 ' CE1' HD21 ' A' ' 709' ' ' LEU . 86.2 t60 -71.3 -38.8 71.76 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.673 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.415 HD13 ' SD ' ' A' ' 640' ' ' MET . 47.6 mt -58.33 -49.8 75.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.016 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 634' ' ' ARG . . . . . 0.455 ' HG3' ' N ' ' A' ' 635' ' ' SER . 3.6 ptp180 -64.74 -40.32 95.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.866 0.365 . . . . 0.0 110.474 179.731 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 635' ' ' SER . . . . . 0.455 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 0.5 OUTLIER -73.86 -11.63 60.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.946 179.262 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 636' ' ' GLN . . . . . 0.409 ' HG3' ' NE2' ' A' ' 632' ' ' HIS . 33.4 mm-40 -98.6 -7.12 28.66 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.564 -179.639 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 114.05 -1.05 24.17 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.584 -0.817 . . . . 0.0 112.497 179.728 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 638' ' ' ILE . . . . . 0.409 HG21 ' CZ ' ' A' ' 702' ' ' TYR . 12.7 mt -108.11 104.77 17.61 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-O 120.635 0.255 . . . . 0.0 111.341 -179.4 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.6 121.19 21.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.825 0.345 . . . . 0.0 111.02 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 640' ' ' MET . . . . . 0.415 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.9 ttp -133.56 28.74 3.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.87 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -69.22 -30.71 68.94 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.913 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -71.61 -78.21 0.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.817 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 2.5 pp -179.93 128.37 0.24 Allowed Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.827 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 644' ' ' PRO . . . . . 0.543 ' HB2' HD11 ' A' ' 651' ' ' LEU . 64.6 Cg_endo -73.75 132.72 17.57 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.397 2.065 . . . . 0.0 112.289 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 645' ' ' LEU . . . . . 0.611 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.9 tp -123.67 151.73 42.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.192 0.52 . . . . 0.0 111.276 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 646' ' ' ILE . . . . . 0.81 HD11 ' HA ' ' A' ' 695' ' ' LEU . 0.7 OUTLIER -149.68 133.41 8.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.979 179.108 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 54.93 37.7 63.18 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.365 -0.922 . . . . 0.0 112.228 -179.428 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.89 7.66 66.64 Favored Glycine 0 C--N 1.332 0.335 0 C-N-CA 120.942 -0.647 . . . . 0.0 113.563 179.484 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.9 m -134.36 164.38 27.56 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 117.35 0.575 . . . . 0.0 111.417 -179.233 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 650' ' ' GLU . . . . . 0.611 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.3 OUTLIER -77.69 145.67 36.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.757 179.789 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 651' ' ' LEU . . . . . 0.615 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.93 145.15 47.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.384 -179.71 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -98.3 111.93 24.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.888 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -52.16 -35.74 49.53 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.056 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 654' ' ' ALA . . . . . 0.656 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -68.61 -44.93 73.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.115 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 10.7 t -67.99 -36.73 80.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.656 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 656' ' ' PHE . . . . . 0.581 ' HD2' HD23 ' A' ' 651' ' ' LEU . 0.1 OUTLIER -68.46 -44.47 74.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.826 179.908 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 56.6 t80 -58.69 -48.73 80.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.904 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 1.4 ttm180 -59.31 -43.03 92.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.99 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 659' ' ' LEU . . . . . 0.67 HD11 ' CE ' ' A' ' 681' ' ' MET . 0.2 OUTLIER -56.22 -49.71 73.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.145 -179.835 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 660' ' ' ILE . . . . . 0.604 HG23 HG21 ' A' ' 669' ' ' VAL . 16.9 mt -57.43 -44.71 85.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.821 0.343 . . . . 0.0 110.786 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -65.31 -47.52 76.28 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.271 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -55.5 -20.44 12.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.747 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.82 19.6 3.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.517 0.199 . . . . 0.0 111.508 -179.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 90.84 -18.19 51.73 Favored Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.562 -0.827 . . . . 0.0 112.725 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 665' ' ' GLY . . . . . 0.422 ' O ' HG23 ' A' ' 669' ' ' VAL . . . 147.37 175.34 20.12 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.369 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 666' ' ' MET . . . . . 0.507 ' O ' HG22 ' A' ' 670' ' ' THR . 0.0 OUTLIER -72.04 -36.69 69.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.898 0.38 . . . . 0.0 111.067 -179.928 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 667' ' ' GLN . . . . . 0.405 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 10.4 pt20 -56.08 -42.78 77.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.255 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 668' ' ' GLN . . . . . 0.549 ' HG3' HD11 ' A' ' 672' ' ' LEU . 0.0 OUTLIER -65.07 -45.14 86.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.956 0.408 . . . . 0.0 110.82 -179.988 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 669' ' ' VAL . . . . . 0.604 HG21 HG23 ' A' ' 660' ' ' ILE . 57.7 t -57.64 -55.71 19.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.564 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 670' ' ' THR . . . . . 0.507 HG22 ' O ' ' A' ' 666' ' ' MET . 9.7 t -76.04 -54.18 7.24 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.219 0.822 . . . . 0.0 113.219 -178.539 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 671' ' ' ASP . . . . . 0.507 ' N ' HG23 ' A' ' 670' ' ' THR . 7.1 t0 -56.21 -51.11 69.26 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -178.328 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 672' ' ' LEU . . . . . 0.549 HD11 ' HG3' ' A' ' 668' ' ' GLN . 28.0 mt -75.0 -1.81 24.36 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -179.117 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 11.3 mttp 50.46 84.15 0.04 OUTLIER 'General case' 0 CA--C 1.521 -0.151 0 CA-C-O 121.098 0.475 . . . . 0.0 110.371 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 5.6 tptm -148.73 21.63 1.01 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.138 -179.776 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 675' ' ' TRP . . . . . 1.114 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 27.5 m95 -56.26 -29.8 61.58 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 121.469 0.652 . . . . 0.0 109.996 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -56.45 -41.5 76.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.633 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.39 -51.75 10.29 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -179.309 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 1.02 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -57.32 -39.81 76.6 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.747 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 679' ' ' ALA . . . . . 0.822 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.56 -34.64 70.16 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.45 179.053 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -53.59 -47.78 69.82 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.267 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 681' ' ' MET . . . . . 0.67 ' CE ' HD11 ' A' ' 659' ' ' LEU . 0.0 OUTLIER -65.89 -21.55 66.46 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.779 179.306 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 682' ' ' LEU . . . . . 0.473 HD23 ' O ' ' A' ' 678' ' ' LEU . 3.1 mm? -78.28 -2.85 39.94 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.46 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 683' ' ' ARG . . . . . 0.691 ' C ' HD12 ' A' ' 684' ' ' ILE . 0.5 OUTLIER 71.66 71.79 0.17 Allowed 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.928 0.394 . . . . 0.0 111.251 179.842 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 684' ' ' ILE . . . . . 0.691 HD12 ' C ' ' A' ' 683' ' ' ARG . 2.1 mp -124.67 135.57 26.81 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.368 179.701 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -64.92 124.58 13.31 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.563 2.176 . . . . 0.0 112.506 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.79 -17.27 63.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.294 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.42 -24.0 67.09 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.702 0.287 . . . . 0.0 111.237 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 688' ' ' ALA . . . . . 0.423 ' HB3' ' HD3' ' A' ' 691' ' ' ARG . . . -79.31 112.28 16.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.921 0.391 . . . . 0.0 110.873 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -72.39 -68.35 0.48 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.329 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.44 -12.9 0.78 Allowed 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -179.153 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 691' ' ' ARG . . . . . 0.673 ' HG2' HD22 ' A' ' 692' ' ' LEU . 43.5 ptt85 -47.95 -42.79 28.41 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 120.919 0.39 . . . . 0.0 111.076 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 692' ' ' LEU . . . . . 0.673 HD22 ' HG2' ' A' ' 691' ' ' ARG . 2.5 mm? -60.99 -46.95 88.67 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.041 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.28 -39.0 68.67 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.886 0.375 . . . . 0.0 111.242 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 2.4 mttm -64.45 -38.73 92.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.246 179.676 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 1.114 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.9 OUTLIER -67.09 -44.23 80.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.488 179.756 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.443 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 4.2 mm-40 -55.43 -48.03 75.06 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.011 0.434 . . . . 0.0 110.816 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -76.82 -29.45 55.96 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.01 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 698' ' ' ALA . . . . . 0.433 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.35 -37.87 83.93 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.675 -179.733 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 699' ' ' TYR . . . . . 0.503 ' CZ ' ' HE3' ' A' ' 666' ' ' MET . 1.3 p90 -84.34 -35.08 23.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.892 0.377 . . . . 0.0 110.691 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 700' ' ' CYS . . . . . . . . . . . . . 28.8 t -64.86 -30.54 71.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.956 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -98.56 -2.41 38.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.581 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 702' ' ' TYR . . . . . 0.433 ' CD1' ' O ' ' A' ' 698' ' ' ALA . 4.8 m-85 -118.44 -78.83 0.59 Allowed 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.85 0.357 . . . . 0.0 111.343 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 90.9 mt -59.82 -40.86 89.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.636 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.424 HD23 ' CD1' ' A' ' 699' ' ' TYR . 0.8 OUTLIER -58.23 -55.34 36.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.92 0.39 . . . . 0.0 111.252 -179.682 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.57 -54.94 34.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.046 -179.656 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 706' ' ' TYR . . . . . 0.414 ' HA ' ' CD1' ' A' ' 709' ' ' LEU . 77.0 t80 -58.4 -50.32 74.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.206 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.78 -27.12 64.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.28 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 18.0 p -79.45 -16.88 55.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.178 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 709' ' ' LEU . . . . . 0.847 HD21 ' CE1' ' A' ' 632' ' ' HIS . 63.1 mt -53.37 147.34 10.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.935 0.398 . . . . 0.0 111.484 -179.826 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 710' ' ' SER . . . . . 0.454 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.4 OUTLIER -76.32 169.03 22.88 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.476 179.492 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 711' ' ' PRO . . . . . 0.454 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 15.9 Cg_endo -57.48 -21.61 46.58 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.473 2.115 . . . . 0.0 112.531 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 712' ' ' GLU . . . . . 0.419 ' O ' ' HG3' ' A' ' 715' ' ' ARG . 8.7 pt-20 -70.53 -53.6 15.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.056 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 713' ' ' GLU . . . . . 0.477 ' HB2' ' HB3' ' A' ' 709' ' ' LEU . 5.3 mm-40 -59.17 -26.05 64.44 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.521 -0.308 . . . . 0.0 111.125 -179.843 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 11.6 m-70 -75.91 -54.25 7.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.038 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 715' ' ' ARG . . . . . 0.419 ' HG3' ' O ' ' A' ' 712' ' ' GLU . 0.0 OUTLIER -64.1 -32.88 74.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.654 -179.243 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 7.9 mtt-85 -77.15 -54.22 6.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.926 0.393 . . . . 0.0 111.209 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 717' ' ' LEU . . . . . 0.494 ' O ' HG23 ' A' ' 721' ' ' VAL . 63.8 mt -62.74 -40.29 96.78 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.802 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 718' ' ' GLU . . . . . 0.722 ' HG2' HD22 ' A' ' 722' ' ' LEU . 16.8 tt0 -65.24 -54.59 27.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.637 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 719' ' ' LYS . . . . . 0.409 ' CG ' ' O ' ' A' ' 715' ' ' ARG . 0.7 OUTLIER -51.07 -36.76 41.76 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.425 -179.622 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 720' ' ' GLU . . . . . 0.417 ' O ' ' HG2' ' A' ' 723' ' ' MET . 2.3 mt-10 -67.36 -55.78 12.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.977 0.418 . . . . 0.0 110.653 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 721' ' ' VAL . . . . . 0.494 HG23 ' O ' ' A' ' 717' ' ' LEU . 39.5 t -61.92 -54.16 38.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.076 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 722' ' ' LEU . . . . . 0.722 HD22 ' HG2' ' A' ' 718' ' ' GLU . 4.6 mp -48.95 -45.67 42.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.858 -179.155 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 723' ' ' MET . . . . . 0.615 ' O ' HD12 ' A' ' 727' ' ' ILE . 15.7 ptp -73.11 -42.0 63.41 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 120.464 -0.495 . . . . 0.0 109.859 179.314 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 724' ' ' GLU . . . . . 0.4 ' N ' ' HG3' ' A' ' 723' ' ' MET . 2.2 mm-40 -54.23 -31.24 52.83 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.31 -179.779 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 725' ' ' LYS . . . . . 0.444 ' HD2' ' CE2' ' A' ' 619' ' ' TRP . 3.5 pttm -86.16 -36.61 19.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.335 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 726' ' ' GLU . . . . . 0.426 ' N ' ' HG3' ' A' ' 725' ' ' LYS . 4.9 mt-10 -71.65 -52.86 15.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.911 0.386 . . . . 0.0 111.124 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 727' ' ' ILE . . . . . 0.615 HD12 ' O ' ' A' ' 723' ' ' MET . 3.7 mp -87.63 11.66 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.68 -179.77 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.73 -48.96 79.39 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.745 0.307 . . . . 0.0 111.101 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -57.34 -32.46 66.75 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.1 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.197 -0.906 . . . . 0.0 110.884 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 112.587 -0.205 . . . . 0.0 112.587 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_exo -51.91 -53.41 7.03 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.641 2.227 . . . . 0.0 112.285 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.1 mp -71.39 165.58 23.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.919 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . -113.94 63.39 0.3 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.509 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -152.74 109.0 3.38 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.81 0.338 . . . . 0.0 110.924 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 9.9 mt -119.17 -178.91 3.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.891 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -99.38 -78.68 1.4 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.516 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.25 -143.07 0.38 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 110.578 -0.156 . . . . 0.0 110.578 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 15.6 mmt85 70.41 147.24 0.07 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.802 0.334 . . . . 0.0 110.698 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 619' ' ' TRP . . . . . 0.462 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.1 OUTLIER -76.55 -6.99 54.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.565 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 122.42 157.9 10.09 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.42 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -68.84 -36.21 14.07 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.549 2.166 . . . . 0.0 112.025 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 54.9 m-80 -71.87 -30.91 65.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.696 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 623' ' ' VAL . . . . . 0.462 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 38.5 t -75.76 -37.49 35.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.617 179.583 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 624' ' ' GLN . . . . . 0.648 ' CG ' HD11 ' A' ' 722' ' ' LEU . 0.9 OUTLIER -66.39 -43.49 85.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.578 179.758 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 6.3 mmt85 -63.43 -50.45 69.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.567 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 626' ' ' LEU . . . . . 0.505 HD23 ' O ' ' A' ' 626' ' ' LEU . 2.8 tt -61.06 -35.17 76.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.74 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 627' ' ' ALA . . . . . 0.441 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -72.22 -46.06 57.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.204 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -58.39 -46.81 85.65 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.094 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 629' ' ' ILE . . . . . 0.424 HG21 HD23 ' A' ' 653' ' ' LEU . 31.2 mt -66.75 -37.71 80.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.09 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.11 -48.46 81.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.883 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 631' ' ' LYS . . . . . 0.45 ' HD2' HG22 ' A' ' 721' ' ' VAL . 0.8 OUTLIER -63.47 -40.5 97.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.009 -179.945 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 632' ' ' HIS . . . . . 0.621 ' HB2' HD13 ' A' ' 717' ' ' LEU . 67.8 t60 -66.51 -43.78 84.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.829 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.459 HD13 ' SD ' ' A' ' 640' ' ' MET . 49.7 mt -56.38 -49.92 73.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.175 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 634' ' ' ARG . . . . . 0.435 ' HG3' ' N ' ' A' ' 635' ' ' SER . 0.9 OUTLIER -60.82 -40.64 93.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.813 0.339 . . . . 0.0 110.717 179.914 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 635' ' ' SER . . . . . 0.435 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 49.1 m -73.74 -19.52 60.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.024 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -90.08 -10.46 44.65 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.586 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 119.07 -7.04 12.97 Favored Glycine 0 C--N 1.331 0.298 0 C-N-CA 120.613 -0.804 . . . . 0.0 112.524 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 638' ' ' ILE . . . . . 0.653 ' N ' HD12 ' A' ' 638' ' ' ILE . 3.6 mp -101.18 104.62 16.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.669 0.271 . . . . 0.0 111.143 -179.662 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 1.6 m -78.34 108.14 11.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.895 0.379 . . . . 0.0 110.869 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 640' ' ' MET . . . . . 0.459 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.9 mtp -122.33 28.61 7.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.98 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -61.0 -31.38 70.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.853 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 51.8 mm-40 -72.39 -78.23 0.09 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.865 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 1.1 pp -177.37 138.54 0.42 Allowed Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.888 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 644' ' ' PRO . . . . . 0.448 ' HB2' HD11 ' A' ' 651' ' ' LEU . 74.2 Cg_endo -75.65 136.92 19.71 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.562 2.175 . . . . 0.0 112.379 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 645' ' ' LEU . . . . . 0.659 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.6 tp -133.75 150.95 51.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.245 0.545 . . . . 0.0 111.267 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 646' ' ' ILE . . . . . 0.61 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.4 tt -149.82 133.93 8.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.702 178.846 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.15 39.95 58.77 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.319 -0.943 . . . . 0.0 112.429 -179.416 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.03 7.14 61.86 Favored Glycine 0 C--N 1.333 0.381 0 C-N-CA 120.904 -0.665 . . . . 0.0 113.799 179.242 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -133.57 164.26 27.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 117.396 0.598 . . . . 0.0 111.374 -179.403 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 650' ' ' GLU . . . . . 0.659 ' HA ' HD12 ' A' ' 645' ' ' LEU . 3.2 mt-10 -79.33 144.35 34.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.748 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 651' ' ' LEU . . . . . 0.624 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.59 144.99 48.25 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.306 -179.745 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 652' ' ' ASP . . . . . 0.493 ' OD1' ' HB3' ' A' ' 654' ' ' ALA . 10.9 t0 -94.81 105.09 17.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.932 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 653' ' ' LEU . . . . . 0.424 HD23 HG21 ' A' ' 629' ' ' ILE . 5.6 mp -53.88 -38.69 65.02 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.975 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 654' ' ' ALA . . . . . 0.493 ' HB3' ' OD1' ' A' ' 652' ' ' ASP . . . -63.57 -43.16 97.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.982 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 1.7 t -69.82 -31.66 69.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.465 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 656' ' ' PHE . . . . . 0.534 ' HD2' HD23 ' A' ' 651' ' ' LEU . 0.1 OUTLIER -72.42 -44.66 62.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.827 179.789 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -59.75 -48.47 81.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.843 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.75 -43.3 99.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.112 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 659' ' ' LEU . . . . . 0.688 HD13 ' CD2' ' A' ' 682' ' ' LEU . 0.3 OUTLIER -59.57 -49.38 78.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.404 -179.648 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 660' ' ' ILE . . . . . 0.79 HG23 HG21 ' A' ' 669' ' ' VAL . 85.6 mt -56.75 -45.64 82.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.793 0.33 . . . . 0.0 110.993 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -65.76 -44.23 86.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.109 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -64.16 -32.47 74.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.159 -179.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 663' ' ' MET . . . . . 0.467 ' CE ' HG22 ' A' ' 669' ' ' VAL . 1.2 mtm -72.73 -9.6 58.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.479 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 119.27 38.38 0.74 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.339 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 75.93 173.16 34.54 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.718 -0.754 . . . . 0.0 112.428 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 666' ' ' MET . . . . . 0.556 ' O ' HG22 ' A' ' 670' ' ' THR . 10.5 tpt -66.45 -41.67 88.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.682 0.277 . . . . 0.0 111.366 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 667' ' ' GLN . . . . . 0.427 ' O ' ' HB2' ' A' ' 671' ' ' ASP . 13.3 pt20 -50.37 -46.66 56.1 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -179.157 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 668' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -50.78 69.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.887 0.375 . . . . 0.0 111.059 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 669' ' ' VAL . . . . . 0.79 HG21 HG23 ' A' ' 660' ' ' ILE . 48.9 t -55.74 -55.5 17.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.911 -179.748 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 670' ' ' THR . . . . . 0.587 HG23 ' OD1' ' A' ' 671' ' ' ASP . 15.2 t -75.95 -52.45 10.25 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -178.007 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 671' ' ' ASP . . . . . 0.587 ' OD1' HG23 ' A' ' 670' ' ' THR . 0.8 OUTLIER -60.79 -50.97 71.33 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -178.203 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 26.3 mt -76.39 1.61 15.84 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 2.3 mttm 49.86 82.96 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.021 0.439 . . . . 0.0 110.266 -179.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 1.4 ttmp? -142.73 23.73 1.91 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.304 -179.552 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 675' ' ' TRP . . . . . 1.113 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 37.8 m95 -62.4 -27.64 69.23 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.337 0.589 . . . . 0.0 110.211 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -57.67 -45.48 85.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.482 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.01 -51.61 13.17 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.742 0.306 . . . . 0.0 111.445 -179.382 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.981 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -56.01 -40.55 73.55 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 179.624 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 679' ' ' ALA . . . . . 0.83 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.71 -31.87 67.2 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.496 179.18 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.18 -49.69 71.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.194 179.59 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 681' ' ' MET . . . . . 0.534 ' CE ' HD11 ' A' ' 659' ' ' LEU . 1.9 ttm -62.38 -21.44 65.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.603 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 682' ' ' LEU . . . . . 0.688 ' CD2' HD13 ' A' ' 659' ' ' LEU . 3.4 mm? -80.55 -1.51 42.28 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.371 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 683' ' ' ARG . . . . . 0.64 ' C ' HD12 ' A' ' 684' ' ' ILE . 10.3 mmm180 68.84 71.77 0.28 Allowed 'General case' 0 N--CA 1.462 0.126 0 CA-C-O 120.936 0.398 . . . . 0.0 110.861 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 684' ' ' ILE . . . . . 0.64 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.7 mp -118.78 136.48 24.23 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.926 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.52 123.68 11.43 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.486 2.124 . . . . 0.0 112.272 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -16.85 63.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.387 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.29 -23.79 67.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.01 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 688' ' ' ALA . . . . . 0.495 ' HB1' ' HB2' ' A' ' 691' ' ' ARG . . . -84.51 106.08 15.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.846 0.355 . . . . 0.0 110.95 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -73.17 -68.56 0.48 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.325 -179.576 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -51.97 -19.76 2.0 Allowed 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -179.405 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 691' ' ' ARG . . . . . 0.495 ' HB2' ' HB1' ' A' ' 688' ' ' ALA . 0.0 OUTLIER -46.2 -39.43 9.74 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.789 0.328 . . . . 0.0 111.223 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -58.61 -45.35 89.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.844 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.11 -37.51 69.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.99 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.8 -40.85 97.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.224 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 1.113 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.3 OUTLIER -65.44 -44.31 87.71 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.18 179.499 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.431 ' O ' ' CD2' ' A' ' 699' ' ' TYR . 42.9 tt0 -55.76 -45.88 77.98 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.884 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.25 -29.89 54.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.041 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 698' ' ' ALA . . . . . 0.449 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -66.42 -37.58 85.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.483 -179.757 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 699' ' ' TYR . . . . . 0.527 ' CZ ' ' HE2' ' A' ' 666' ' ' MET . 1.7 p90 -86.04 -33.92 20.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.074 0.464 . . . . 0.0 110.233 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 700' ' ' CYS . . . . . 0.543 ' HA ' HD23 ' A' ' 704' ' ' LEU . 1.4 m -63.1 -30.53 71.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.867 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -100.97 -1.81 33.44 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.478 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 702' ' ' TYR . . . . . 0.554 ' CE2' HG21 ' A' ' 638' ' ' ILE . 4.5 m-85 -117.57 -75.94 0.58 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.94 0.4 . . . . 0.0 111.4 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 20.2 mt -64.27 -41.73 96.78 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.812 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.543 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.4 OUTLIER -47.92 -56.91 6.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.848 0.356 . . . . 0.0 111.431 -179.496 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 1.4 m -54.64 -46.44 73.93 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.27 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 706' ' ' TYR . . . . . 0.608 ' O ' HD22 ' A' ' 709' ' ' LEU . 67.7 t80 -63.43 -29.47 70.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.346 -179.699 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -96.92 -2.47 43.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.709 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 57.8 m -113.2 -21.57 10.93 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.727 0.298 . . . . 0.0 111.36 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 709' ' ' LEU . . . . . 0.664 HD23 ' O ' ' A' ' 709' ' ' LEU . 0.2 OUTLIER -69.56 171.54 8.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.885 179.981 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -72.66 164.29 61.36 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.008 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.26 -29.88 54.81 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.544 2.163 . . . . 0.0 111.959 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -51.07 -50.81 57.97 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.75 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 713' ' ' GLU . . . . . 0.453 ' HB2' ' CD1' ' A' ' 709' ' ' LEU . 1.6 mm-40 -58.26 -28.21 64.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.935 179.758 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 714' ' ' HIS . . . . . 0.535 ' CD2' HD21 ' A' ' 709' ' ' LEU . 1.7 m170 -76.02 -54.01 7.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.583 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.68 -44.64 96.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.37 -179.59 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 2.0 mtp-105 -65.66 -54.16 31.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.273 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 717' ' ' LEU . . . . . 0.621 HD13 ' HB2' ' A' ' 632' ' ' HIS . 76.8 mt -62.98 -41.13 99.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.787 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 718' ' ' GLU . . . . . 0.65 ' HG3' HD13 ' A' ' 722' ' ' LEU . 30.3 tt0 -66.82 -54.12 25.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.3 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.74 -34.62 27.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.347 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 720' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' A' ' 723' ' ' MET . 6.0 mt-10 -68.54 -55.63 11.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.009 0.433 . . . . 0.0 110.428 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 721' ' ' VAL . . . . . 0.45 HG22 ' HD2' ' A' ' 631' ' ' LYS . 44.7 t -61.55 -53.66 45.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.808 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 722' ' ' LEU . . . . . 0.65 HD13 ' HG3' ' A' ' 718' ' ' GLU . 3.6 mp -48.69 -46.43 40.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.884 -179.31 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 723' ' ' MET . . . . . 0.564 ' HB2' HD13 ' A' ' 727' ' ' ILE . 16.5 ptp -71.49 -41.01 69.85 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.566 -0.454 . . . . 0.0 109.873 179.399 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 724' ' ' GLU . . . . . 0.417 ' N ' ' HG3' ' A' ' 723' ' ' MET . 1.9 mm-40 -53.48 -32.8 51.79 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.403 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 725' ' ' LYS . . . . . 0.456 ' HD3' ' CE2' ' A' ' 619' ' ' TRP . 8.7 pttt -86.18 -41.92 14.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.314 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 726' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 722' ' ' LEU . 13.7 mt-10 -66.23 -54.0 30.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.882 0.373 . . . . 0.0 111.147 -179.763 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 727' ' ' ILE . . . . . 0.631 ' O ' HG22 ' A' ' 727' ' ' ILE . 4.3 mp -86.94 11.51 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.746 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 1.7 tt -57.65 -42.15 82.88 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.817 0.342 . . . . 0.0 111.168 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -59.62 -51.06 71.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.123 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 730' ' ' LYS . . . . . 0.49 ' HD3' HG23 ' A' ' 727' ' ' ILE . 9.4 mtpt . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.861 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.19 0 N-CA-C 112.453 -0.259 . . . . 0.0 112.453 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -68.1 -39.71 10.14 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.569 2.179 . . . . 0.0 112.302 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -71.45 178.11 3.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.88 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 105.36 -83.01 0.35 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.506 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 5.4 p 59.22 108.93 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.849 0.357 . . . . 0.0 110.969 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 6.3 mt -138.98 -169.92 2.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.888 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -122.91 -94.41 1.18 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.492 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 1.6 mmm180 -147.52 121.74 9.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.047 0.451 . . . . 0.0 110.716 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.78 125.38 50.49 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.893 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 619' ' ' TRP . . . . . 0.535 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.0 OUTLIER -61.0 -18.38 57.35 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.29 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 120.57 169.14 13.84 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.489 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -68.15 -38.71 11.8 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.59 2.193 . . . . 0.0 112.174 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 622' ' ' ASN . . . . . 0.533 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 59.5 m-80 -62.46 -42.64 99.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.93 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 623' ' ' VAL . . . . . 0.464 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 40.5 t -72.15 -35.01 51.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.845 179.704 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 624' ' ' GLN . . . . . 0.603 ' CG ' HD11 ' A' ' 722' ' ' LEU . 0.9 OUTLIER -57.7 -47.32 82.69 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.766 179.882 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.69 -43.5 75.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.796 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 626' ' ' LEU . . . . . 0.545 HD23 ' O ' ' A' ' 626' ' ' LEU . 6.2 tt -59.7 -36.93 77.51 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.971 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 627' ' ' ALA . . . . . 0.455 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -72.77 -46.29 54.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.293 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.17 -46.82 82.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.054 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 23.5 mt -66.63 -40.04 85.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.122 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 6.1 ttpt -62.9 -49.41 74.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.905 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 631' ' ' LYS . . . . . 0.478 ' HD2' HG22 ' A' ' 721' ' ' VAL . 2.7 tttm -58.13 -42.57 86.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.036 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 632' ' ' HIS . . . . . 0.74 ' HB2' HD13 ' A' ' 717' ' ' LEU . 79.9 t60 -68.27 -41.92 80.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.974 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.592 HD13 ' SD ' ' A' ' 640' ' ' MET . 39.1 mt -56.04 -47.41 77.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.21 -179.69 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 1.7 ptt180 -65.43 -41.75 93.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.77 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.78 -13.57 60.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.304 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 636' ' ' GLN . . . . . 0.45 ' CG ' ' CE1' ' A' ' 632' ' ' HIS . 22.7 mm100 -96.21 -9.46 30.41 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.619 -179.658 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 118.89 -9.86 12.3 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.595 -0.812 . . . . 0.0 112.371 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 638' ' ' ILE . . . . . 0.638 ' N ' HD12 ' A' ' 638' ' ' ILE . 3.5 mp -98.79 104.75 16.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.708 0.29 . . . . 0.0 111.074 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -80.61 116.08 20.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.963 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 640' ' ' MET . . . . . 0.592 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.5 ttp -124.26 16.66 9.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.182 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.79 -31.21 62.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.839 0.352 . . . . 0.0 111.036 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -70.91 -73.67 0.17 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.786 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 1.9 pp -179.73 130.77 0.25 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.749 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.11 124.79 9.81 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.432 2.088 . . . . 0.0 112.287 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 645' ' ' LEU . . . . . 0.644 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.8 tp -127.36 152.76 47.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.28 0.562 . . . . 0.0 111.323 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 646' ' ' ILE . . . . . 0.483 HG22 ' HB3' ' A' ' 651' ' ' LEU . 4.4 tt -149.65 133.42 8.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.486 178.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 50.71 43.01 46.46 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.25 -0.976 . . . . 0.0 112.212 -179.31 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 68.86 6.77 53.44 Favored Glycine 0 CA--C 1.52 0.39 0 C-N-CA 121.068 -0.587 . . . . 0.0 113.908 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 62.4 m -130.9 161.97 30.69 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 117.609 0.705 . . . . 0.0 111.636 -179.072 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 650' ' ' GLU . . . . . 0.644 ' HA ' HD12 ' A' ' 645' ' ' LEU . 10.3 mt-10 -80.41 142.57 34.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.759 179.76 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 651' ' ' LEU . . . . . 0.638 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -135.16 145.3 47.64 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.298 -179.742 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -96.36 111.64 23.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.787 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -51.97 -38.94 58.41 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.029 -179.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 654' ' ' ALA . . . . . 0.533 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -65.04 -44.35 89.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.055 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -68.55 -33.9 74.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.862 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 656' ' ' PHE . . . . . 0.432 ' CE2' ' HG ' ' A' ' 682' ' ' LEU . 0.7 OUTLIER -72.88 -45.16 59.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.853 -179.96 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -61.39 -46.48 89.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.725 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.96 -45.32 95.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.816 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 659' ' ' LEU . . . . . 0.622 HD12 ' HB2' ' A' ' 678' ' ' LEU . 0.2 OUTLIER -56.62 -48.76 76.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.933 -179.975 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 660' ' ' ILE . . . . . 0.746 HG21 ' HG2' ' A' ' 666' ' ' MET . 76.9 mt -58.2 -45.48 88.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.927 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 14.4 m-20 -64.74 -46.54 81.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.231 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.38 -40.71 71.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.179 -179.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 663' ' ' MET . . . . . 0.401 ' HE1' ' N ' ' A' ' 678' ' ' LEU . 0.0 OUTLIER -65.95 -27.22 68.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.028 -179.983 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 131.69 46.98 0.12 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.347 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 75.99 176.45 40.81 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.505 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 666' ' ' MET . . . . . 0.746 ' HG2' HG21 ' A' ' 660' ' ' ILE . 0.0 OUTLIER -73.11 -30.58 63.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.768 0.318 . . . . 0.0 111.109 -179.975 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 667' ' ' GLN . . . . . 0.423 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 4.3 pt20 -57.25 -45.77 83.67 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.641 -179.499 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 668' ' ' GLN . . . . . 0.466 ' HA ' HD13 ' A' ' 672' ' ' LEU . 0.0 OUTLIER -66.5 -52.76 42.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.838 0.351 . . . . 0.0 111.336 -179.615 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 669' ' ' VAL . . . . . 0.728 HG21 HG23 ' A' ' 660' ' ' ILE . 66.8 t -49.51 -54.97 5.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.572 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 670' ' ' THR . . . . . 0.613 HG22 ' O ' ' A' ' 666' ' ' MET . 12.3 t -76.18 -49.59 16.8 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 -178.407 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 671' ' ' ASP . . . . . 0.471 ' N ' HG23 ' A' ' 670' ' ' THR . 7.9 t70 -62.95 -51.16 67.96 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -177.856 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 672' ' ' LEU . . . . . 0.466 HD13 ' HA ' ' A' ' 668' ' ' GLN . 10.7 mp -79.04 3.6 16.85 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -179.04 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 14.7 ttmm 48.56 84.81 0.03 OUTLIER 'General case' 0 C--O 1.231 0.13 0 CA-C-O 120.971 0.415 . . . . 0.0 110.507 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt -145.06 22.9 1.54 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.24 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 675' ' ' TRP . . . . . 1.087 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 39.4 m95 -61.24 -28.63 69.3 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 121.397 0.617 . . . . 0.0 110.112 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 -56.9 -43.9 81.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.484 -179.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.14 -51.52 12.0 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.755 0.312 . . . . 0.0 111.44 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.969 HD22 ' HA ' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.59 -40.39 71.98 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 179.645 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 679' ' ' ALA . . . . . 0.835 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.83 -33.61 68.62 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.513 179.074 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.33 -49.5 66.96 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.211 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 19.9 mtm -62.92 -22.62 66.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.67 179.257 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 682' ' ' LEU . . . . . 0.477 HD23 ' O ' ' A' ' 678' ' ' LEU . 3.5 mm? -79.53 -1.23 36.74 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.333 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 683' ' ' ARG . . . . . 0.667 ' C ' HD12 ' A' ' 684' ' ' ILE . 0.2 OUTLIER 69.38 71.81 0.25 Allowed 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 120.951 0.405 . . . . 0.0 111.065 -179.83 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 684' ' ' ILE . . . . . 0.667 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.7 mp -119.81 135.7 24.39 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.72 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.99 123.16 10.9 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.411 2.074 . . . . 0.0 112.375 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -16.4 63.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.167 179.853 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.46 -23.74 66.99 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.12 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 688' ' ' ALA . . . . . 0.422 ' CB ' ' HB2' ' A' ' 691' ' ' ARG . . . -85.25 105.36 15.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.834 0.349 . . . . 0.0 111.011 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 -70.32 -68.35 0.43 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.141 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -53.33 -17.8 2.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.909 -179.563 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 691' ' ' ARG . . . . . 0.61 ' NE ' HG23 ' A' ' 684' ' ' ILE . 0.0 OUTLIER -46.82 -35.25 6.08 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.905 0.383 . . . . 0.0 111.143 179.904 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 692' ' ' LEU . . . . . 0.413 HD13 ' HA ' ' A' ' 692' ' ' LEU . 3.8 mm? -66.28 -40.74 90.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.869 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.11 -37.65 69.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.889 179.659 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 20.9 mmtt -64.3 -40.66 96.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.173 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 1.087 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.8 OUTLIER -64.83 -44.55 89.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.377 179.545 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.445 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 3.1 mt-30 -55.42 -46.3 76.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.815 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.08 -29.63 55.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.132 179.888 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -67.49 -38.53 84.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.581 -179.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 699' ' ' TYR . . . . . 0.779 ' HB2' HD12 ' A' ' 703' ' ' LEU . 1.1 p90 -85.69 -31.82 22.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.948 0.404 . . . . 0.0 110.516 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 700' ' ' CYS . . . . . 0.43 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 1.6 m -65.77 -30.61 71.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.476 179.509 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -97.11 -8.47 30.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.37 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 702' ' ' TYR . . . . . 0.419 ' CE2' HG21 ' A' ' 638' ' ' ILE . 4.0 m-85 -113.47 -78.99 0.58 Allowed 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.829 0.347 . . . . 0.0 111.367 -179.659 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 703' ' ' LEU . . . . . 0.779 HD12 ' HB2' ' A' ' 699' ' ' TYR . 61.6 mt -56.17 -46.55 79.31 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.618 -179.441 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.452 HD23 ' CE1' ' A' ' 699' ' ' TYR . 1.0 OUTLIER -53.97 -48.62 70.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.901 0.382 . . . . 0.0 110.887 -179.928 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 705' ' ' SER . . . . . 0.638 ' O ' HD13 ' A' ' 709' ' ' LEU . 4.4 m -54.63 -54.97 34.54 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.347 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 706' ' ' TYR . . . . . 0.497 ' CE2' ' CE1' ' A' ' 714' ' ' HIS . 18.4 t80 -46.81 -43.59 18.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.787 -179.678 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -94.49 1.61 55.73 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 29.7 t -80.56 -20.29 43.74 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 709' ' ' LEU . . . . . 0.638 HD13 ' O ' ' A' ' 705' ' ' SER . 0.0 OUTLIER -94.62 -174.27 3.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.824 0.345 . . . . 0.0 111.46 -179.768 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 710' ' ' SER . . . . . 0.416 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.4 OUTLIER -85.3 167.06 27.54 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.965 -179.817 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 711' ' ' PRO . . . . . 0.416 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 18.8 Cg_endo -58.92 -17.86 39.44 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.608 2.205 . . . . 0.0 112.765 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -60.12 -52.75 64.02 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.8 0.333 . . . . 0.0 110.889 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 713' ' ' GLU . . . . . 0.436 ' O ' HD12 ' A' ' 717' ' ' LEU . 65.9 mm-40 -64.47 -25.88 68.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.955 179.752 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 714' ' ' HIS . . . . . 0.497 ' CE1' ' CE2' ' A' ' 706' ' ' TYR . 0.1 OUTLIER -74.91 -54.63 6.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.171 179.599 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 15.5 mmm180 -65.25 -36.21 83.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.274 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 18.6 mtt180 -65.52 -54.23 31.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.822 0.344 . . . . 0.0 110.993 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 717' ' ' LEU . . . . . 0.74 HD13 ' HB2' ' A' ' 632' ' ' HIS . 30.5 mt -62.77 -34.84 78.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.694 179.788 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 718' ' ' GLU . . . . . 0.703 ' HG2' HD22 ' A' ' 722' ' ' LEU . 27.0 tt0 -69.39 -53.9 17.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.394 179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -52.34 -34.09 45.72 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.432 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 720' ' ' GLU . . . . . 0.449 ' O ' ' HG2' ' A' ' 723' ' ' MET . 1.0 OUTLIER -69.35 -55.81 9.33 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.019 0.437 . . . . 0.0 110.389 179.775 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 721' ' ' VAL . . . . . 0.617 HG23 ' O ' ' A' ' 717' ' ' LEU . 21.5 t -61.8 -53.13 52.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.053 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 722' ' ' LEU . . . . . 0.703 HD22 ' HG2' ' A' ' 718' ' ' GLU . 6.9 mp -51.81 -42.49 62.54 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.009 -179.271 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 723' ' ' MET . . . . . 0.605 ' O ' HD12 ' A' ' 727' ' ' ILE . 14.2 ptp -71.91 -39.71 69.32 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.487 -0.485 . . . . 0.0 109.994 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 724' ' ' GLU . . . . . 0.416 ' N ' ' HG3' ' A' ' 723' ' ' MET . 1.4 mt-10 -56.29 -32.0 64.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.291 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 725' ' ' LYS . . . . . 0.457 ' HD3' ' CE2' ' A' ' 619' ' ' TRP . 7.5 pttt -86.15 -43.84 12.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.298 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -63.96 -48.43 76.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.922 0.392 . . . . 0.0 110.982 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 727' ' ' ILE . . . . . 0.654 ' O ' HG22 ' A' ' 727' ' ' ILE . 4.3 mp -89.46 11.57 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.526 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 1.5 tt -57.69 -34.52 69.51 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.794 0.33 . . . . 0.0 110.959 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -76.88 -53.08 8.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.953 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 3.1 mttt . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.935 179.979 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.161 0 N-CA-C 112.515 -0.234 . . . . 0.0 112.515 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -52.55 -35.46 66.99 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.555 2.17 . . . . 0.0 112.272 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.8 mt -71.96 -175.46 1.45 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.849 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 111.1 -24.66 15.72 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.608 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 8.7 t -94.65 43.88 1.1 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.851 0.357 . . . . 0.0 110.961 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 615' ' ' LEU . . . . . 0.76 HD22 ' NH1' ' A' ' 617' ' ' ARG . 25.9 mt -83.04 169.09 16.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.875 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -168.24 54.06 0.22 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.525 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 617' ' ' ARG . . . . . 0.76 ' NH1' HD22 ' A' ' 615' ' ' LEU . 2.3 mpp_? -123.24 -146.0 0.35 Allowed 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 110.433 -0.21 . . . . 0.0 110.433 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.42 117.01 10.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.94 0.4 . . . . 0.0 111.038 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 619' ' ' TRP . . . . . 0.435 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.5 OUTLIER -60.75 173.15 0.79 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.813 179.853 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . -55.99 170.58 2.22 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.468 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.76 -49.42 2.28 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.509 2.139 . . . . 0.0 112.09 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 622' ' ' ASN . . . . . 0.584 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 0.4 OUTLIER -58.61 -20.64 49.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.288 -179.938 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 623' ' ' VAL . . . . . 0.435 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 28.9 t -75.7 -45.93 37.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.911 0.386 . . . . 0.0 110.472 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.08 -43.81 94.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.163 179.341 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.06 -50.86 71.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.537 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 7.4 tt -62.54 -33.27 74.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.949 0.404 . . . . 0.0 110.542 179.551 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 627' ' ' ALA . . . . . 0.573 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -69.46 -46.83 65.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.267 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -62.28 -44.64 96.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.128 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 629' ' ' ILE . . . . . 0.467 ' HA ' ' CD2' ' A' ' 632' ' ' HIS . 14.6 mt -60.54 -45.08 97.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.99 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 630' ' ' LYS . . . . . 0.482 ' HA ' HD12 ' A' ' 633' ' ' LEU . 13.8 ttpt -64.13 -34.32 77.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.231 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.36 -48.03 74.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.641 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 632' ' ' HIS . . . . . 0.468 ' HB3' HD13 ' A' ' 717' ' ' LEU . 1.1 p80 -68.53 -37.83 80.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.823 0.344 . . . . 0.0 110.558 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.489 HD13 ' SD ' ' A' ' 640' ' ' MET . 32.1 mt -55.73 -49.95 71.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.121 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 634' ' ' ARG . . . . . 0.408 ' HG3' ' N ' ' A' ' 635' ' ' SER . 4.1 ptt180 -65.25 -40.99 94.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.78 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 635' ' ' SER . . . . . 0.408 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 1.4 m -73.75 -13.33 60.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.408 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 636' ' ' GLN . . . . . 0.587 HE22 HD21 ' A' ' 709' ' ' LEU . 0.0 OUTLIER -97.39 -6.56 33.79 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.661 -179.654 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 111.96 4.21 26.11 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.6 -0.809 . . . . 0.0 112.57 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 638' ' ' ILE . . . . . . . . . . . . . 17.7 mt -110.77 106.09 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-O 120.72 0.295 . . . . 0.0 111.238 -179.421 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.2 118.4 24.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.892 0.377 . . . . 0.0 110.816 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 640' ' ' MET . . . . . 0.489 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.5 ttp -121.45 23.01 10.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.174 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -58.08 -30.61 66.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.011 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -71.23 -79.49 0.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.853 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -178.36 133.82 0.31 Allowed Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.839 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -77.79 118.24 4.44 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.582 2.188 . . . . 0.0 112.388 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 645' ' ' LEU . . . . . 0.636 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.9 tp -118.58 152.55 35.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.226 0.536 . . . . 0.0 111.181 179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 646' ' ' ILE . . . . . 0.661 HD11 ' HA ' ' A' ' 695' ' ' LEU . 15.8 tt -149.67 133.88 8.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.828 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 52.28 40.24 52.59 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.363 -0.922 . . . . 0.0 112.239 -179.394 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.33 8.0 61.49 Favored Glycine 0 C--N 1.333 0.382 0 C-N-CA 120.913 -0.66 . . . . 0.0 113.686 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.2 m -133.51 163.3 29.68 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 117.366 0.583 . . . . 0.0 111.368 -179.298 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 650' ' ' GLU . . . . . 0.636 ' HA ' HD12 ' A' ' 645' ' ' LEU . 5.0 mt-10 -79.84 144.67 33.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.657 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 651' ' ' LEU . . . . . 0.615 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.62 145.07 48.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.352 -179.783 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -97.08 109.76 22.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.841 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 653' ' ' LEU . . . . . 0.561 HD12 ' CD2' ' A' ' 651' ' ' LEU . 5.7 mp -52.14 -37.84 55.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.004 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 654' ' ' ALA . . . . . 0.584 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -66.05 -44.05 85.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.174 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 5.7 t -69.9 -36.45 75.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.67 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 656' ' ' PHE . . . . . 0.435 ' CZ ' ' HG ' ' A' ' 682' ' ' LEU . 0.2 OUTLIER -70.93 -45.85 63.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.831 179.998 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -57.73 -50.57 72.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.993 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.87 -41.17 95.41 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.989 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 659' ' ' LEU . . . . . 0.843 HD22 HD23 ' A' ' 682' ' ' LEU . 0.1 OUTLIER -59.0 -49.85 76.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.111 -179.794 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 660' ' ' ILE . . . . . 0.783 HG23 HG21 ' A' ' 669' ' ' VAL . 62.8 mt -56.87 -46.14 83.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.767 0.318 . . . . 0.0 110.882 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -61.81 -38.08 86.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.016 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 51.6 tt0 -66.69 -14.73 62.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.422 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.16 33.59 1.72 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.824 0.345 . . . . 0.0 111.101 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 72.46 25.16 74.94 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.641 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 97.48 169.61 32.93 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.583 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 666' ' ' MET . . . . . 0.507 ' HE2' ' CE1' ' A' ' 699' ' ' TYR . 9.6 tpt -64.82 -37.47 87.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.703 0.287 . . . . 0.0 111.116 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 667' ' ' GLN . . . . . 0.448 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 16.0 pt20 -50.79 -44.13 58.76 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.308 -179.765 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 668' ' ' GLN . . . . . 0.472 ' HA ' HD13 ' A' ' 672' ' ' LEU . 0.0 OUTLIER -65.85 -52.74 47.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.903 0.382 . . . . 0.0 110.922 179.959 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 669' ' ' VAL . . . . . 0.783 HG21 HG23 ' A' ' 660' ' ' ILE . 48.4 t -49.57 -55.83 4.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.687 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 670' ' ' THR . . . . . 0.511 HG23 ' N ' ' A' ' 671' ' ' ASP . 14.0 t -76.27 -53.67 7.9 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.658 0.984 . . . . 0.0 113.658 -178.491 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 671' ' ' ASP . . . . . 0.511 ' N ' HG23 ' A' ' 670' ' ' THR . 6.3 t70 -58.56 -51.17 71.03 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -177.654 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 672' ' ' LEU . . . . . 0.472 HD13 ' HA ' ' A' ' 668' ' ' GLN . 9.1 mp -77.22 1.84 17.27 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -178.886 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 49.07 83.43 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.13 0.49 . . . . 0.0 110.532 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.18 22.7 1.36 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.646 -0.707 . . . . 0.0 110.981 -179.768 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 675' ' ' TRP . . . . . 1.121 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 29.3 m95 -58.47 -28.63 65.51 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 121.391 0.615 . . . . 0.0 110.204 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 14.8 m-80 -56.11 -41.59 75.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.895 -179.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 6.3 mmtp -77.8 -51.82 9.89 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 120.703 0.287 . . . . 0.0 111.66 -179.172 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 1.056 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -58.06 -40.86 82.07 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.862 -0.421 . . . . 0.0 109.862 179.689 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 679' ' ' ALA . . . . . 0.801 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.56 -33.76 69.38 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.423 179.028 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.74 -49.07 68.96 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.395 179.513 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 2.9 ttp -64.57 -22.37 66.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.906 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 682' ' ' LEU . . . . . 0.843 HD23 HD22 ' A' ' 659' ' ' LEU . 3.1 mm? -78.3 -2.99 40.7 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.446 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 683' ' ' ARG . . . . . 0.697 ' C ' HD12 ' A' ' 684' ' ' ILE . 37.7 mmt180 70.02 71.8 0.23 Allowed 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.979 0.418 . . . . 0.0 111.497 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 684' ' ' ILE . . . . . 0.697 HD12 ' C ' ' A' ' 683' ' ' ARG . 2.0 mp -122.22 141.9 35.59 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.073 179.401 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 685' ' ' PRO . . . . . 0.661 ' HD2' HG23 ' A' ' 684' ' ' ILE . 51.3 Cg_endo -69.67 119.42 6.37 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.511 2.141 . . . . 0.0 112.655 -179.563 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 8.3 mmmt -69.87 -21.89 63.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.095 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -65.35 -21.6 66.71 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.389 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 688' ' ' ALA . . . . . 0.758 ' HB3' ' HG2' ' A' ' 691' ' ' ARG . . . -72.58 115.75 12.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.873 0.368 . . . . 0.0 111.007 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 67.0 mm-40 -83.39 5.9 21.93 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.49 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -123.81 -15.19 7.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.946 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 691' ' ' ARG . . . . . 0.788 ' HG3' HD22 ' A' ' 692' ' ' LEU . 0.0 OUTLIER -53.42 -33.1 52.68 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-O 120.744 0.307 . . . . 0.0 110.951 -179.609 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 692' ' ' LEU . . . . . 0.788 HD22 ' HG3' ' A' ' 691' ' ' ARG . 3.2 mm? -70.57 -49.54 46.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.056 179.758 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.19 -39.65 68.46 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.501 -179.693 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 6.3 mtpt -64.01 -38.85 92.58 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.033 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 1.121 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 4.0 tp -65.08 -47.32 77.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.827 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.413 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 43.5 mt-30 -55.33 -46.8 76.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.105 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -76.95 -29.67 55.69 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.131 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 698' ' ' ALA . . . . . 0.415 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.97 -37.48 81.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.797 -179.506 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 699' ' ' TYR . . . . . 0.539 ' HB2' HD12 ' A' ' 703' ' ' LEU . 1.2 p90 -86.6 -33.5 20.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.032 0.444 . . . . 0.0 110.442 179.819 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 700' ' ' CYS . . . . . 0.513 ' HA ' HD23 ' A' ' 704' ' ' LEU . 1.8 m -65.78 -30.46 71.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.887 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -98.53 -1.52 40.92 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.549 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 702' ' ' TYR . . . . . 0.415 ' CD1' ' O ' ' A' ' 698' ' ' ALA . 7.6 m-85 -122.55 -75.94 0.59 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.791 0.329 . . . . 0.0 111.308 -179.87 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 703' ' ' LEU . . . . . 0.631 HD13 HD12 ' A' ' 660' ' ' ILE . 19.7 mt -56.0 -44.55 78.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.439 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.513 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.9 OUTLIER -54.84 -27.17 40.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.15 -179.91 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 705' ' ' SER . . . . . 0.441 ' HB3' ' CE1' ' A' ' 632' ' ' HIS . 0.2 OUTLIER -67.99 -55.52 12.37 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.557 179.901 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 706' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -53.15 -46.62 68.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.147 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -74.82 -19.42 60.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.526 -179.793 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 40.0 t -88.99 -35.21 16.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.767 0.318 . . . . 0.0 111.21 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 709' ' ' LEU . . . . . 0.587 HD21 HE22 ' A' ' 636' ' ' GLN . 71.8 mt -56.67 150.06 16.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.184 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 710' ' ' SER . . . . . 0.428 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.5 OUTLIER -75.7 166.82 42.1 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.8 179.953 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 711' ' ' PRO . . . . . 0.428 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 11.4 Cg_endo -54.8 -26.08 45.99 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.542 2.161 . . . . 0.0 112.334 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.84 -53.35 58.43 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.747 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 713' ' ' GLU . . . . . 0.457 ' O ' HD12 ' A' ' 717' ' ' LEU . 5.7 mm-40 -60.21 -26.21 66.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.033 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 17.4 m170 -75.83 -54.38 7.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.944 0.402 . . . . 0.0 110.471 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 17.0 mtt180 -60.56 -47.62 85.4 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.461 -179.618 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.93 -54.17 34.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.568 -179.394 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 717' ' ' LEU . . . . . 0.468 HD13 ' HB3' ' A' ' 632' ' ' HIS . 73.9 mt -62.38 -41.93 99.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.978 -179.738 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -65.95 -54.25 28.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.836 0.35 . . . . 0.0 110.2 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 1.5 mmpt? -50.42 -33.57 21.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.331 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 720' ' ' GLU . . . . . 0.426 ' O ' ' HG2' ' A' ' 723' ' ' MET . 12.7 mt-10 -69.25 -55.36 10.76 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.578 179.648 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 721' ' ' VAL . . . . . 0.573 HG11 ' HB1' ' A' ' 627' ' ' ALA . 25.2 t -64.06 -54.99 24.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.922 -179.828 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 722' ' ' LEU . . . . . 0.446 ' O ' ' HG3' ' A' ' 725' ' ' LYS . 1.1 mp -49.16 -43.37 41.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.724 -179.524 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 723' ' ' MET . . . . . 0.531 ' O ' HD12 ' A' ' 727' ' ' ILE . 8.0 ptp -73.85 -40.48 63.25 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.562 -0.455 . . . . 0.0 109.942 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -51.08 -38.06 49.43 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.532 -179.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 725' ' ' LYS . . . . . 0.446 ' HG3' ' O ' ' A' ' 722' ' ' LEU . 0.0 OUTLIER -86.08 -34.78 20.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.732 0.301 . . . . 0.0 111.088 -179.787 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -65.35 -54.33 30.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.026 0.441 . . . . 0.0 110.789 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 727' ' ' ILE . . . . . 0.62 ' O ' HG22 ' A' ' 727' ' ' ILE . 4.1 mp -88.48 11.49 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.539 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 2.7 tt -59.12 -48.0 83.2 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.833 0.349 . . . . 0.0 111.094 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -60.51 -50.05 75.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.097 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 730' ' ' LYS . . . . . 0.405 ' HD2' HG23 ' A' ' 727' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.873 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.191 0 N-CA-C 112.478 -0.249 . . . . 0.0 112.478 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 611' ' ' PRO . . . . . 0.515 ' HG2' HD12 ' A' ' 612' ' ' LEU . 45.1 Cg_endo -68.26 -47.33 1.67 Allowed 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.534 2.156 . . . . 0.0 112.402 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 612' ' ' LEU . . . . . 0.515 HD12 ' HG2' ' A' ' 611' ' ' PRO . 2.5 mp -73.68 177.3 5.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.85 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 84.04 -71.14 3.03 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.476 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 30.1 t 60.59 91.24 0.06 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.817 0.342 . . . . 0.0 110.902 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 3.6 mt -118.0 163.69 16.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.882 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 59.46 70.83 0.89 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.496 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.53 -144.08 0.36 Allowed 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 110.587 -0.153 . . . . 0.0 110.587 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.8 124.38 19.59 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.005 0.431 . . . . 0.0 111.159 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 619' ' ' TRP . . . . . 0.456 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.5 OUTLIER -52.43 178.6 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.779 179.598 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . -66.3 169.48 32.35 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.452 -0.88 . . . . 0.0 111.907 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -64.15 -29.04 64.98 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.365 2.044 . . . . 0.0 111.862 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 46.4 m-80 -63.94 -38.61 91.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.932 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 623' ' ' VAL . . . . . 0.442 ' HB ' ' CG ' ' A' ' 619' ' ' TRP . 41.4 t -73.3 -36.65 49.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.116 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 624' ' ' GLN . . . . . 0.442 ' CG ' HD11 ' A' ' 722' ' ' LEU . 1.1 tm0? -59.41 -48.09 82.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.839 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.49 -49.41 66.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.024 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 9.6 tt -62.32 -31.19 71.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.063 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 627' ' ' ALA . . . . . 0.562 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -66.79 -52.16 47.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.3 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 1.3 m -57.14 -53.19 60.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.124 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 629' ' ' ILE . . . . . 0.678 HG21 HD23 ' A' ' 653' ' ' LEU . 18.8 mt -58.92 -39.84 78.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.054 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 4.1 tmmm? -59.81 -40.48 88.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.837 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 631' ' ' LYS . . . . . 0.452 ' HD3' HD22 ' A' ' 717' ' ' LEU . 4.8 tttm -66.08 -40.76 91.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.001 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 632' ' ' HIS . . . . . 0.749 ' CE1' HD11 ' A' ' 709' ' ' LEU . 67.3 t60 -68.34 -44.95 74.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.031 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.469 HD21 ' CD2' ' A' ' 702' ' ' TYR . 25.6 mt -56.53 -49.82 73.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.26 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 18.4 ptt180 -61.87 -41.72 98.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.841 0.353 . . . . 0.0 110.913 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.63 -19.49 60.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.25 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 34.4 tp60 -89.1 -8.55 53.62 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.646 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 113.3 3.92 24.0 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.39 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 638' ' ' ILE . . . . . 0.429 HG21 ' CE2' ' A' ' 702' ' ' TYR . 17.2 mt -111.5 104.83 17.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-O 120.747 0.308 . . . . 0.0 111.267 -179.44 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -82.59 110.78 17.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.868 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 640' ' ' MET . . . . . 0.428 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.8 ttp -121.11 30.73 6.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.966 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.32 -29.81 71.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.873 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 642' ' ' GLU . . . . . 0.556 ' O ' HD12 ' A' ' 643' ' ' LEU . 12.0 mt-10 -71.57 -76.18 0.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.019 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 643' ' ' LEU . . . . . 0.556 HD12 ' O ' ' A' ' 642' ' ' GLU . 0.1 OUTLIER -179.75 139.24 0.32 Allowed Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.846 -179.99 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_endo -77.95 138.52 16.6 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.603 2.202 . . . . 0.0 112.455 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 645' ' ' LEU . . . . . 0.659 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.8 tp -134.9 151.21 50.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.229 0.538 . . . . 0.0 111.121 179.737 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 646' ' ' ILE . . . . . 0.632 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.2 tt -148.96 132.55 7.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.386 -0.824 . . . . 0.0 109.533 178.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 52.26 43.18 56.97 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.3 -0.952 . . . . 0.0 112.21 -179.274 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 68.71 6.61 51.49 Favored Glycine 0 C--N 1.334 0.453 0 C-N-CA 121.032 -0.604 . . . . 0.0 113.91 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 87.0 m -131.51 163.07 28.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 117.507 0.654 . . . . 0.0 111.513 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 650' ' ' GLU . . . . . 0.659 ' HA ' HD12 ' A' ' 645' ' ' LEU . 2.7 mt-10 -80.5 143.88 32.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.798 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 651' ' ' LEU . . . . . 0.614 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -135.0 144.93 47.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.344 -179.841 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -94.02 107.99 19.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.971 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 653' ' ' LEU . . . . . 0.678 HD23 HG21 ' A' ' 629' ' ' ILE . 7.2 mp -54.32 -42.89 70.67 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.997 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -61.44 -46.68 89.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.013 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 1.1 t -66.79 -35.6 80.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.743 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 656' ' ' PHE . . . . . 0.425 ' CZ ' ' HG ' ' A' ' 682' ' ' LEU . 0.2 OUTLIER -70.68 -42.46 70.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.887 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -59.78 -52.04 67.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.039 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 16.9 ttt180 -59.97 -43.41 95.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.093 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 659' ' ' LEU . . . . . 0.477 HD13 HD21 ' A' ' 682' ' ' LEU . 0.1 OUTLIER -56.84 -43.32 80.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.024 -179.845 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 660' ' ' ILE . . . . . 0.718 HG23 HG21 ' A' ' 669' ' ' VAL . 89.4 mt -64.26 -43.61 97.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.736 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -64.17 -45.89 86.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.052 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -61.23 -21.0 63.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.178 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.81 8.77 21.4 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.503 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 98.87 25.64 9.59 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.638 -0.792 . . . . 0.0 112.644 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 92.0 174.8 42.48 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.561 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 666' ' ' MET . . . . . 0.683 ' HG2' HG21 ' A' ' 660' ' ' ILE . 0.0 OUTLIER -69.66 -25.69 64.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.661 0.267 . . . . 0.0 111.09 179.863 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 667' ' ' GLN . . . . . 0.404 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 15.9 pt20 -59.1 -48.51 81.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.797 -179.358 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 668' ' ' GLN . . . . . 0.442 ' HG3' HD22 ' A' ' 672' ' ' LEU . 0.0 OUTLIER -64.82 -52.81 54.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.897 0.379 . . . . 0.0 111.225 -179.483 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 669' ' ' VAL . . . . . 0.718 HG21 HG23 ' A' ' 660' ' ' ILE . 57.5 t -49.54 -55.35 4.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.681 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 670' ' ' THR . . . . . 0.659 HG22 ' O ' ' A' ' 666' ' ' MET . 10.6 t -76.44 -48.53 19.38 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 -178.176 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 671' ' ' ASP . . . . . 0.456 ' N ' HG23 ' A' ' 670' ' ' THR . 5.0 t70 -66.31 -51.08 60.93 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -177.649 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 672' ' ' LEU . . . . . 0.442 HD22 ' HG3' ' A' ' 668' ' ' GLN . 11.1 mp -77.52 3.83 12.6 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -179.046 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 48.92 84.18 0.03 OUTLIER 'General case' 0 C--O 1.231 0.125 0 CA-C-O 120.936 0.398 . . . . 0.0 110.446 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 62.1 tttt -145.65 22.16 1.46 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.327 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 675' ' ' TRP . . . . . 1.109 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 34.9 m95 -61.13 -28.91 69.45 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 121.381 0.61 . . . . 0.0 110.125 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -56.02 -43.43 77.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.546 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.41 -51.61 11.5 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 120.687 0.28 . . . . 0.0 111.538 -179.279 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.979 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.01 -41.21 71.0 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 179.738 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 679' ' ' ALA . . . . . 0.827 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.55 -34.66 70.19 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.743 179.346 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -53.23 -48.54 68.08 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.452 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 3.9 ttm -63.81 -21.56 66.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.702 179.361 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 682' ' ' LEU . . . . . 0.477 HD21 HD13 ' A' ' 659' ' ' LEU . 2.2 mm? -80.48 -1.87 43.49 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.402 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 683' ' ' ARG . . . . . 0.752 ' C ' HD12 ' A' ' 684' ' ' ILE . 0.3 OUTLIER 71.23 71.74 0.18 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.887 0.375 . . . . 0.0 111.293 179.95 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 684' ' ' ILE . . . . . 0.752 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.7 mp -120.57 137.16 25.93 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.626 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 685' ' ' PRO . . . . . 0.427 ' HD2' HG23 ' A' ' 684' ' ' ILE . 41.8 Cg_endo -67.51 123.91 11.38 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.47 2.113 . . . . 0.0 112.328 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 686' ' ' LYS . . . . . 0.428 ' HE3' HG23 ' A' ' 687' ' ' THR . 0.7 OUTLIER -69.94 -13.7 62.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.412 -179.968 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 687' ' ' THR . . . . . 0.428 HG23 ' HE3' ' A' ' 686' ' ' LYS . 1.5 p -65.34 -22.28 66.8 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.748 0.309 . . . . 0.0 111.253 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 688' ' ' ALA . . . . . 0.453 ' CB ' ' HB2' ' A' ' 691' ' ' ARG . . . -88.46 100.16 12.83 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.889 0.376 . . . . 0.0 110.937 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 13.1 mp0 -68.53 -67.56 0.46 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.289 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -52.81 -19.26 2.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.872 -179.549 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 691' ' ' ARG . . . . . 0.658 HH22 HD22 ' A' ' 695' ' ' LEU . 0.0 OUTLIER -45.39 -42.04 9.76 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.783 0.325 . . . . 0.0 111.347 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 692' ' ' LEU . . . . . 0.428 HD13 ' HA ' ' A' ' 692' ' ' LEU . 3.6 mm? -56.58 -42.69 79.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.955 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.99 -37.18 69.9 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.79 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 1.3 ttpp -64.62 -40.23 95.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.241 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 1.109 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.4 OUTLIER -65.13 -44.08 89.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.254 179.517 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.461 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 2.0 mt-30 -55.48 -45.96 76.94 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.798 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -77.16 -29.66 54.59 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.073 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 698' ' ' ALA . . . . . 0.412 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.63 -39.03 84.66 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.599 -179.796 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 699' ' ' TYR . . . . . 0.461 ' CE2' ' HA ' ' A' ' 696' ' ' GLN . 1.3 p90 -84.72 -32.78 23.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.88 0.371 . . . . 0.0 110.488 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 700' ' ' CYS . . . . . 0.472 ' HA ' HD23 ' A' ' 704' ' ' LEU . 32.6 t -66.03 -30.62 71.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.721 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -97.65 -2.07 42.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.329 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 702' ' ' TYR . . . . . 0.469 ' CD2' HD21 ' A' ' 633' ' ' LEU . 6.8 m-85 -121.61 -74.83 0.6 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.869 0.366 . . . . 0.0 111.245 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 703' ' ' LEU . . . . . 0.471 ' CD2' HD12 ' A' ' 660' ' ' ILE . 1.7 tp -58.37 -48.4 80.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.589 -179.374 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.472 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.6 OUTLIER -50.17 -47.62 54.38 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.861 0.362 . . . . 0.0 111.481 -179.663 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.66 -55.19 32.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.128 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 706' ' ' TYR . . . . . 0.513 ' CD1' HD12 ' A' ' 709' ' ' LEU . 57.9 t80 -66.78 -29.7 69.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.276 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -76.29 -18.82 58.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.43 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 36.6 p -95.87 -14.65 23.0 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.703 0.287 . . . . 0.0 111.437 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 709' ' ' LEU . . . . . 0.749 HD11 ' CE1' ' A' ' 632' ' ' HIS . 70.2 mt -56.46 151.12 13.83 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.939 0.4 . . . . 0.0 111.358 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 710' ' ' SER . . . . . 0.418 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.6 OUTLIER -78.76 169.73 19.38 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.603 179.66 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 711' ' ' PRO . . . . . 0.418 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 55.7 Cg_endo -70.06 -12.83 33.07 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.519 2.146 . . . . 0.0 112.851 -179.765 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -75.47 -56.78 4.37 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.847 0.356 . . . . 0.0 111.109 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 713' ' ' GLU . . . . . 0.699 ' CD ' HD22 ' A' ' 709' ' ' LEU . 0.0 OUTLIER -68.93 -25.41 64.56 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.689 179.939 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 714' ' ' HIS . . . . . 0.406 ' CE1' ' CE2' ' A' ' 706' ' ' TYR . 0.4 OUTLIER -70.03 -54.79 11.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.298 -0.41 . . . . 0.0 109.921 179.361 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 2.2 tpt180 -60.65 -40.31 91.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.056 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 27.6 ttp180 -65.33 -53.78 38.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.091 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 717' ' ' LEU . . . . . 0.591 HD12 ' HG3' ' A' ' 713' ' ' GLU . 47.1 mt -60.45 -41.48 94.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.795 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 718' ' ' GLU . . . . . 0.729 ' HG3' HD13 ' A' ' 722' ' ' LEU . 41.7 tt0 -66.99 -54.15 24.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.441 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.8 -31.6 27.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.482 -179.754 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 720' ' ' GLU . . . . . 0.425 ' O ' ' HG2' ' A' ' 723' ' ' MET . 18.4 mm-40 -72.06 -55.39 7.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.006 0.431 . . . . 0.0 110.514 179.798 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 721' ' ' VAL . . . . . 0.562 HG11 ' HB1' ' A' ' 627' ' ' ALA . 40.2 t -62.6 -54.6 31.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.757 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 722' ' ' LEU . . . . . 0.729 HD13 ' HG3' ' A' ' 718' ' ' GLU . 7.0 mp -53.6 -40.81 66.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.852 -179.389 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 723' ' ' MET . . . . . 0.722 ' O ' HD12 ' A' ' 727' ' ' ILE . 8.2 ptp -71.34 -39.15 71.52 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.024 179.551 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 724' ' ' GLU . . . . . 0.426 ' N ' ' HG3' ' A' ' 723' ' ' MET . 6.6 mm-40 -57.92 -31.32 66.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.119 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 725' ' ' LYS . . . . . 0.448 ' HD3' ' NE1' ' A' ' 619' ' ' TRP . 11.4 pttt -86.12 -34.45 20.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.443 -179.685 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 726' ' ' GLU . . . . . 0.409 ' N ' ' HG3' ' A' ' 725' ' ' LYS . 3.5 mm-40 -73.5 -47.55 40.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.282 -179.529 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 727' ' ' ILE . . . . . 0.722 HD12 ' O ' ' A' ' 723' ' ' MET . 4.0 mp -88.16 11.6 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.635 -179.789 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 3.2 tt -64.41 -35.75 81.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.817 0.341 . . . . 0.0 110.837 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -58.64 -43.6 89.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.985 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 1.7 mtmt . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.858 -179.992 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.155 0 N-CA-C 112.538 -0.225 . . . . 0.0 112.538 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.91 -32.45 17.93 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.569 2.179 . . . . 0.0 112.343 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.32 156.16 39.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.892 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 164.85 149.34 5.78 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.51 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -112.74 31.1 6.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.813 0.339 . . . . 0.0 110.912 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 25.0 mt -95.26 -179.08 4.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.86 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -143.21 78.08 0.27 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.479 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 17.5 mmt85 -118.29 -144.88 0.37 Allowed 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 110.479 -0.193 . . . . 0.0 110.479 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.76 135.93 33.4 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.861 0.362 . . . . 0.0 111.024 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 619' ' ' TRP . . . . . 0.454 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.1 OUTLIER -66.67 -13.95 61.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.387 179.967 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 124.29 165.08 12.12 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.363 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -70.6 -41.93 2.88 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.596 2.197 . . . . 0.0 112.461 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 622' ' ' ASN . . . . . 0.413 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 7.1 p30 -66.75 -30.93 71.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.01 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 623' ' ' VAL . . . . . 0.454 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 55.5 t -74.96 -40.8 45.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.917 0.389 . . . . 0.0 110.442 179.391 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 35.7 tp60 -65.09 -34.59 78.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.951 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 81.6 mtm-85 -64.7 -50.72 65.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.248 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 626' ' ' LEU . . . . . 0.825 HD13 ' O ' ' A' ' 626' ' ' LEU . 2.0 tm? -62.02 -32.14 72.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.691 179.592 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -74.04 -53.92 8.96 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.744 -179.666 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 25.0 p -57.07 -42.38 80.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.24 -179.509 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 629' ' ' ILE . . . . . 0.595 HG22 ' CD1' ' A' ' 633' ' ' LEU . 55.4 mt -68.68 -40.48 81.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.882 0.373 . . . . 0.0 110.732 179.718 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 2.5 ttpt -62.0 -46.57 88.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.718 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 5.3 tttm -65.18 -40.52 94.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.088 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 632' ' ' HIS . . . . . 0.586 ' CE1' ' HG3' ' A' ' 636' ' ' GLN . 26.9 t-80 -68.85 -44.85 72.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.084 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.613 HD13 ' SD ' ' A' ' 640' ' ' MET . 35.6 mt -56.21 -49.91 72.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.308 -179.623 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -62.73 -42.29 99.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.997 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.74 -16.1 61.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.299 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 636' ' ' GLN . . . . . 0.586 ' HG3' ' CE1' ' A' ' 632' ' ' HIS . 67.8 mm-40 -92.67 -9.12 42.0 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.563 -179.758 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 114.41 0.33 23.52 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.374 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 638' ' ' ILE . . . . . 0.555 HD11 ' OE1' ' A' ' 701' ' ' GLN . 11.4 mt -108.16 105.41 18.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 CA-C-O 120.767 0.318 . . . . 0.0 111.254 -179.531 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.29 109.82 17.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.851 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 640' ' ' MET . . . . . 0.613 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.7 mtp -118.16 28.71 8.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.961 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.88 -38.15 90.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.903 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -60.96 -76.4 0.05 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.997 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 643' ' ' LEU . . . . . 0.543 HD13 ' HD2' ' A' ' 644' ' ' PRO . 0.2 OUTLIER -178.74 123.28 0.24 Allowed Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.761 179.949 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 644' ' ' PRO . . . . . 0.543 ' HD2' HD13 ' A' ' 643' ' ' LEU . 29.6 Cg_endo -63.26 139.95 74.73 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.488 2.125 . . . . 0.0 112.33 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 645' ' ' LEU . . . . . 0.659 HD12 ' HA ' ' A' ' 650' ' ' GLU . 5.0 tp -142.01 153.2 44.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.269 0.557 . . . . 0.0 111.223 179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 646' ' ' ILE . . . . . 0.51 HD11 ' HA ' ' A' ' 695' ' ' LEU . 3.2 tt -149.84 133.76 8.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.466 178.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 49.72 43.43 37.99 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.192 -1.004 . . . . 0.0 111.98 -179.226 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 68.48 6.02 46.7 Favored Glycine 0 CA--C 1.521 0.427 0 C-N-CA 121.149 -0.548 . . . . 0.0 113.972 179.409 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.3 m -129.58 160.89 31.87 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 117.586 0.693 . . . . 0.0 111.697 -178.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 650' ' ' GLU . . . . . 0.659 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.9 OUTLIER -78.9 140.62 38.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.824 179.856 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 651' ' ' LEU . . . . . 0.632 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.63 144.92 48.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.14 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -96.86 111.65 23.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.866 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 653' ' ' LEU . . . . . 0.4 ' HB2' ' CD2' ' A' ' 626' ' ' LEU . 3.4 mm? -54.62 -37.77 66.01 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.89 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 654' ' ' ALA . . . . . 0.413 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -63.91 -46.0 86.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.893 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 33.8 t -66.71 -35.43 80.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.646 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 656' ' ' PHE . . . . . 0.405 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.3 OUTLIER -70.53 -44.58 67.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.783 179.852 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 36.2 t80 -58.01 -43.26 86.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.73 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -66.1 -43.59 86.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.692 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 659' ' ' LEU . . . . . 0.675 HD21 ' HE2' ' A' ' 681' ' ' MET . 0.1 OUTLIER -56.68 -52.39 65.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.215 -179.844 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 660' ' ' ILE . . . . . 0.721 HG23 HG21 ' A' ' 669' ' ' VAL . 57.1 mt -57.87 -45.19 87.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.049 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -64.61 -44.27 91.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.396 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -55.13 -22.9 18.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.412 -179.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 12.6 mtm -95.49 35.91 1.3 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.853 0.358 . . . . 0.0 110.845 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 88.23 -50.8 3.91 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.354 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 665' ' ' GLY . . . . . 0.413 ' O ' HG23 ' A' ' 669' ' ' VAL . . . 171.76 -174.73 45.23 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 121.025 -0.607 . . . . 0.0 111.914 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 666' ' ' MET . . . . . 0.587 ' O ' HG22 ' A' ' 670' ' ' THR . 11.1 tpt -73.08 -30.35 63.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.872 0.368 . . . . 0.0 110.899 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -57.65 -49.1 77.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.412 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 668' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.66 -52.7 62.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.858 0.361 . . . . 0.0 111.294 -179.751 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 669' ' ' VAL . . . . . 0.721 HG21 HG23 ' A' ' 660' ' ' ILE . 56.4 t -49.31 -55.41 4.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.792 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 670' ' ' THR . . . . . 0.587 HG22 ' O ' ' A' ' 666' ' ' MET . 14.1 t -76.09 -49.64 16.87 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -178.284 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 671' ' ' ASP . . . . . 0.465 ' N ' HG23 ' A' ' 670' ' ' THR . 63.8 m-20 -61.97 -51.07 69.57 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 -177.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 9.1 mp -78.93 5.2 12.14 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 48.87 83.63 0.04 OUTLIER 'General case' 0 C--O 1.231 0.122 0 CA-C-O 120.994 0.426 . . . . 0.0 110.535 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 14.8 mttm -142.46 22.98 2.0 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.188 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 675' ' ' TRP . . . . . 1.111 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 37.7 m95 -61.44 -27.62 68.69 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.358 0.599 . . . . 0.0 110.221 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 -57.3 -45.57 84.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.613 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.45 -51.63 12.58 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 120.703 0.287 . . . . 0.0 111.587 -179.355 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.975 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -54.9 -40.64 70.02 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 179.759 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 679' ' ' ALA . . . . . 0.849 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.78 -33.9 68.99 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.602 179.312 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.22 -50.37 64.88 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.417 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 681' ' ' MET . . . . . 0.675 ' HE2' HD21 ' A' ' 659' ' ' LEU . 2.8 mtp -62.11 -19.88 63.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.78 179.301 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 682' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -84.71 -1.5 56.27 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.384 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 683' ' ' ARG . . . . . 0.758 ' C ' HD12 ' A' ' 684' ' ' ILE . 23.3 mmm-85 70.86 71.69 0.19 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.946 0.403 . . . . 0.0 111.029 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 684' ' ' ILE . . . . . 0.758 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.6 mp -121.1 137.47 26.71 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.654 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 685' ' ' PRO . . . . . 0.418 ' HD2' HG23 ' A' ' 684' ' ' ILE . 38.9 Cg_endo -67.09 121.84 9.06 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.391 2.06 . . . . 0.0 112.381 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.91 -18.95 63.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.269 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -65.37 -22.15 66.77 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.241 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 688' ' ' ALA . . . . . 0.432 ' HB1' ' HG3' ' A' ' 691' ' ' ARG . . . -84.53 105.23 15.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.977 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 20.0 mp0 -70.12 -68.61 0.41 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.164 -179.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -51.73 -20.69 2.25 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.798 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 691' ' ' ARG . . . . . 0.438 ' CZ ' HG13 ' A' ' 684' ' ' ILE . 0.0 OUTLIER -47.98 -36.4 12.59 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.865 0.364 . . . . 0.0 111.121 179.873 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -65.38 -45.72 82.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.898 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.02 -37.9 69.69 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.855 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.92 -39.64 94.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.08 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 1.111 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.2 OUTLIER -65.95 -42.15 90.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.135 179.408 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.432 ' O ' ' CD1' ' A' ' 699' ' ' TYR . 23.5 mt-30 -57.48 -44.09 84.6 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.786 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -77.31 -30.0 53.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.157 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 698' ' ' ALA . . . . . 0.424 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -66.6 -37.75 85.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.442 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 699' ' ' TYR . . . . . 0.554 ' CE2' ' HE2' ' A' ' 666' ' ' MET . 1.8 p90 -86.54 -34.91 19.81 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.108 0.48 . . . . 0.0 109.961 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 700' ' ' CYS . . . . . 0.453 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 52.4 t -61.01 -30.59 70.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.617 179.779 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 701' ' ' GLN . . . . . 0.555 ' OE1' HD11 ' A' ' 638' ' ' ILE . 0.3 OUTLIER -99.75 -3.4 32.91 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.351 179.921 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 702' ' ' TYR . . . . . 0.496 ' CZ ' HG21 ' A' ' 638' ' ' ILE . 4.8 m-85 -115.47 -77.16 0.57 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.882 0.372 . . . . 0.0 111.366 -179.634 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 703' ' ' LEU . . . . . 0.411 ' CD2' HD12 ' A' ' 660' ' ' ILE . 1.9 tp -63.6 -40.63 97.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.662 -179.266 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.545 HD23 ' CE2' ' A' ' 699' ' ' TYR . 0.5 OUTLIER -54.06 -50.63 66.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.902 0.382 . . . . 0.0 111.207 -179.68 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -54.3 -54.6 38.08 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.897 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 706' ' ' TYR . . . . . 0.565 ' O ' HD22 ' A' ' 709' ' ' LEU . 20.4 t80 -57.78 -28.87 64.38 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.415 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -96.99 -1.82 44.79 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.49 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -106.82 -20.82 13.22 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.584 0.23 . . . . 0.0 111.602 -179.436 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 709' ' ' LEU . . . . . 0.565 HD22 ' O ' ' A' ' 706' ' ' TYR . 0.2 OUTLIER -77.54 176.15 9.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.799 0.333 . . . . 0.0 110.97 -179.846 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.16 164.98 57.38 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.158 -179.699 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -66.68 -28.93 43.85 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.653 2.235 . . . . 0.0 112.102 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -48.86 -48.75 41.71 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.702 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 713' ' ' GLU . . . . . 0.516 ' HB2' HD11 ' A' ' 709' ' ' LEU . 3.5 mm-40 -61.34 -26.38 67.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.059 179.713 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -76.04 -54.28 7.09 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.989 0.423 . . . . 0.0 110.322 179.419 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.31 -43.27 96.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.336 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.61 -53.96 34.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.824 0.345 . . . . 0.0 111.168 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 717' ' ' LEU . . . . . 0.451 ' O ' HG23 ' A' ' 721' ' ' VAL . 76.2 mt -62.25 -42.12 99.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.092 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -68.84 -54.21 17.01 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.47 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 6.4 mmtt -50.81 -31.85 18.26 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.106 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 720' ' ' GLU . . . . . 0.428 ' O ' ' HG2' ' A' ' 723' ' ' MET . 13.1 mt-10 -70.96 -55.5 8.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.497 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 721' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 717' ' ' LEU . 35.4 t -63.2 -54.84 27.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.872 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -52.9 -41.11 64.08 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.942 -179.263 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 723' ' ' MET . . . . . 0.583 ' HB2' HD13 ' A' ' 727' ' ' ILE . 15.4 ptp -73.92 -40.72 62.91 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.066 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -54.54 -40.73 68.95 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.312 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 725' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.13 -37.56 18.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.289 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.65 -57.28 8.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.875 0.369 . . . . 0.0 111.029 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 727' ' ' ILE . . . . . 0.632 ' O ' HG22 ' A' ' 727' ' ' ILE . 4.1 mp -88.19 11.64 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.676 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 728' ' ' LEU . . . . . 0.484 ' O ' HD23 ' A' ' 728' ' ' LEU . 1.8 tt -52.22 -41.63 62.89 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.827 0.346 . . . . 0.0 111.159 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -76.4 -59.91 2.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.934 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 13.2 mtmt . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.236 -0.888 . . . . 0.0 110.891 -179.966 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.166 0 N-CA-C 112.513 -0.235 . . . . 0.0 112.513 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -52.38 -29.71 40.25 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.616 2.211 . . . . 0.0 112.31 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.2 mt -79.33 -178.1 6.06 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.9 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 140.47 67.65 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.467 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 32.5 t -133.44 31.62 3.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.788 0.327 . . . . 0.0 110.876 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 12.0 mt -91.31 -176.6 4.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.891 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 109.0 104.06 2.88 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.538 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -135.44 121.52 20.06 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 121.246 0.546 . . . . 0.0 110.763 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.27 136.74 40.06 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.026 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 619' ' ' TRP . . . . . 0.491 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.0 OUTLIER -60.81 -18.48 55.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.248 179.995 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 124.41 165.24 12.14 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.484 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -68.0 -35.38 20.5 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 122.575 2.184 . . . . 0.0 112.222 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 622' ' ' ASN . . . . . 0.577 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 11.0 p30 -66.65 -39.36 88.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.852 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 623' ' ' VAL . . . . . 0.453 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 41.2 t -72.95 -40.84 60.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.77 179.613 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 624' ' ' GLN . . . . . 0.688 ' CG ' HD11 ' A' ' 722' ' ' LEU . 1.1 tm0? -58.0 -41.42 83.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.641 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 625' ' ' ARG . . . . . 0.414 ' O ' HD12 ' A' ' 629' ' ' ILE . 0.0 OUTLIER -68.03 -47.7 67.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.67 179.85 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 626' ' ' LEU . . . . . 0.629 HD23 ' O ' ' A' ' 626' ' ' LEU . 5.6 tt -62.22 -32.92 73.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.004 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -73.92 -50.01 22.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.273 -179.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.08 -47.14 81.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.056 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 629' ' ' ILE . . . . . 0.619 HG21 HD23 ' A' ' 653' ' ' LEU . 12.1 mt -65.42 -41.22 90.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.046 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 9.4 ttpt -61.7 -50.98 70.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.797 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 7.2 tttm -56.58 -41.0 76.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.168 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 632' ' ' HIS . . . . . 0.686 ' HB2' HD13 ' A' ' 717' ' ' LEU . 80.7 t60 -70.97 -43.29 68.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.309 -179.757 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.482 HD13 ' SD ' ' A' ' 640' ' ' MET . 48.1 mt -56.28 -48.01 77.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.166 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 634' ' ' ARG . . . . . 0.402 ' HG3' ' N ' ' A' ' 635' ' ' SER . 38.3 ptt180 -66.04 -41.07 91.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.813 0.34 . . . . 0.0 110.626 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 635' ' ' SER . . . . . 0.402 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 0.1 OUTLIER -73.76 -11.56 60.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.184 179.638 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -98.74 -7.73 27.2 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.605 -0.271 . . . . 0.0 111.659 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 115.52 -0.01 21.89 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.508 -0.853 . . . . 0.0 112.542 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 638' ' ' ILE . . . . . . . . . . . . . 14.5 mt -109.4 104.71 17.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.662 0.268 . . . . 0.0 111.223 -179.474 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.92 113.55 15.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.829 0.347 . . . . 0.0 110.964 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 640' ' ' MET . . . . . 0.482 ' SD ' HD13 ' A' ' 633' ' ' LEU . 2.0 ttp -123.73 31.49 5.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.859 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.7 -33.72 71.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.934 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 642' ' ' GLU . . . . . 0.612 ' HB3' HD23 ' A' ' 643' ' ' LEU . 18.4 mt-10 -70.28 -78.33 0.07 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.893 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 643' ' ' LEU . . . . . 0.612 HD23 ' HB3' ' A' ' 642' ' ' GLU . 2.0 pt? -177.59 132.53 0.34 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.877 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 644' ' ' PRO . . . . . 0.41 ' HB2' HD11 ' A' ' 651' ' ' LEU . 95.4 Cg_endo -79.67 135.3 11.47 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.531 2.154 . . . . 0.0 112.284 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 645' ' ' LEU . . . . . 0.586 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.6 tp -129.09 152.42 48.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.237 0.542 . . . . 0.0 111.216 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 646' ' ' ILE . . . . . 0.672 HD11 ' HA ' ' A' ' 695' ' ' LEU . 4.2 tt -149.74 133.95 8.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.921 179.204 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.41 38.85 58.38 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.362 -0.923 . . . . 0.0 112.198 -179.491 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.14 8.01 64.18 Favored Glycine 0 C--N 1.332 0.335 0 C-N-CA 120.981 -0.628 . . . . 0.0 113.71 179.364 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.3 m -134.38 164.18 28.01 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 117.341 0.571 . . . . 0.0 111.43 -179.365 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 650' ' ' GLU . . . . . 0.586 ' HA ' HD12 ' A' ' 645' ' ' LEU . 13.2 mt-10 -79.98 146.0 32.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.833 179.858 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 651' ' ' LEU . . . . . 0.612 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.54 144.93 48.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.381 -179.824 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -96.91 109.8 22.44 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.859 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 653' ' ' LEU . . . . . 0.619 HD23 HG21 ' A' ' 629' ' ' ILE . 6.8 mp -54.17 -35.96 62.86 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.284 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 654' ' ' ALA . . . . . 0.577 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -65.59 -43.47 89.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.109 -179.895 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -73.01 -34.73 66.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.61 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 656' ' ' PHE . . . . . 0.451 ' CZ ' ' HG ' ' A' ' 682' ' ' LEU . 0.2 OUTLIER -70.92 -47.98 56.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.801 179.866 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -58.71 -52.81 64.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.098 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 2.6 ptm85 -59.1 -40.14 84.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.853 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 659' ' ' LEU . . . . . 0.522 HD23 HD12 ' A' ' 678' ' ' LEU . 0.6 OUTLIER -60.47 -48.78 80.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.332 -179.704 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 660' ' ' ILE . . . . . 0.628 HG23 HG21 ' A' ' 669' ' ' VAL . 29.2 mt -56.71 -45.22 82.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-O 120.834 0.349 . . . . 0.0 110.561 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -63.96 -39.79 94.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.915 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -74.48 -13.9 60.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.486 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -94.24 36.63 1.13 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.716 0.294 . . . . 0.0 111.164 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 73.64 31.57 60.44 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.365 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 665' ' ' GLY . . . . . 0.513 ' O ' HG23 ' A' ' 669' ' ' VAL . . . 82.47 173.15 48.83 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.365 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 666' ' ' MET . . . . . 0.49 ' HE1' ' HB ' ' A' ' 669' ' ' VAL . 0.0 OUTLIER -71.17 -40.55 71.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.738 0.304 . . . . 0.0 111.062 179.985 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -52.57 -43.77 65.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.453 -179.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 668' ' ' GLN . . . . . 0.416 ' HG3' HD11 ' A' ' 672' ' ' LEU . 0.4 OUTLIER -64.81 -40.86 95.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.935 0.398 . . . . 0.0 110.832 179.937 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 669' ' ' VAL . . . . . 0.628 HG21 HG23 ' A' ' 660' ' ' ILE . 58.7 t -57.88 -55.82 19.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.434 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 670' ' ' THR . . . . . 0.497 HG23 ' N ' ' A' ' 671' ' ' ASP . 8.8 t -75.98 -53.88 7.71 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -178.862 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 671' ' ' ASP . . . . . 0.497 ' N ' HG23 ' A' ' 670' ' ' THR . 19.2 t0 -54.21 -50.97 65.88 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -178.561 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 672' ' ' LEU . . . . . 0.416 HD11 ' HG3' ' A' ' 668' ' ' GLN . 25.0 mt -77.77 -1.75 32.95 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 -179.171 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 24.4 mttt 49.46 82.7 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 121.09 0.471 . . . . 0.0 110.433 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 40.0 mttt -146.31 22.47 1.34 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.926 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 675' ' ' TRP . . . . . 1.106 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 31.9 m95 -57.24 -31.02 65.11 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 121.445 0.64 . . . . 0.0 110.073 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -56.84 -40.79 76.72 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.411 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.52 -51.62 10.42 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 120.776 0.322 . . . . 0.0 111.409 -179.545 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.987 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -57.48 -37.4 72.86 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.591 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 679' ' ' ALA . . . . . 0.875 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.48 -37.54 71.29 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.429 179.284 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -53.09 -46.29 68.57 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.314 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 35.0 mtp -65.24 -24.51 67.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.564 179.227 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 682' ' ' LEU . . . . . 0.454 HD23 ' O ' ' A' ' 678' ' ' LEU . 3.3 mm? -78.15 -2.07 35.73 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.535 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 683' ' ' ARG . . . . . 0.667 ' C ' HD12 ' A' ' 684' ' ' ILE . 1.6 mpp_? 68.68 71.79 0.28 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.883 0.373 . . . . 0.0 111.401 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 684' ' ' ILE . . . . . 0.667 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.9 mp -124.25 137.53 29.26 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.352 179.525 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 685' ' ' PRO . . . . . 0.402 ' HD2' HG23 ' A' ' 684' ' ' ILE . 24.8 Cg_endo -62.04 116.08 3.24 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.332 2.022 . . . . 0.0 112.298 -179.821 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -20.19 66.33 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.95 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 12.7 p -67.65 -23.87 65.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.204 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 688' ' ' ALA . . . . . 0.611 ' HB3' ' HG2' ' A' ' 691' ' ' ARG . . . -64.64 111.02 2.55 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.986 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 19.9 mm-40 -83.06 4.85 24.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.559 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -121.78 -16.64 7.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.65 179.243 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 691' ' ' ARG . . . . . 0.818 ' HG3' HD22 ' A' ' 692' ' ' LEU . 2.3 ppt_? -52.66 -32.07 40.37 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.473 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 692' ' ' LEU . . . . . 0.818 HD22 ' HG3' ' A' ' 691' ' ' ARG . 2.7 mm? -70.51 -54.54 11.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.729 0.299 . . . . 0.0 111.488 -179.785 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.78 -39.03 70.19 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.406 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 694' ' ' LYS . . . . . 0.406 ' O ' ' HB2' ' A' ' 698' ' ' ALA . 0.7 OUTLIER -63.55 -37.36 87.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.979 0.419 . . . . 0.0 109.98 179.442 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 1.106 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 3.9 tp -65.54 -47.76 74.77 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.854 179.736 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.432 ' HA ' ' CD2' ' A' ' 699' ' ' TYR . 14.7 tt0 -55.19 -47.8 74.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.254 -179.621 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -77.2 -29.81 54.46 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.247 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 698' ' ' ALA . . . . . 0.417 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.78 -37.06 81.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.754 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 699' ' ' TYR . . . . . 0.482 ' CZ ' ' HE3' ' A' ' 666' ' ' MET . 1.4 p90 -86.28 -34.95 20.21 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.008 0.432 . . . . 0.0 110.361 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 700' ' ' CYS . . . . . 0.412 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 1.7 m -64.23 -30.57 71.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.784 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 25.0 tt0 -97.3 -3.44 40.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.451 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 702' ' ' TYR . . . . . 0.417 ' CD1' ' O ' ' A' ' 698' ' ' ALA . 5.6 m-85 -117.42 -78.59 0.58 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.824 0.345 . . . . 0.0 111.315 -179.716 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 703' ' ' LEU . . . . . 0.544 HD13 HD12 ' A' ' 660' ' ' ILE . 77.9 mt -58.29 -45.78 87.32 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.532 -179.535 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.471 HD23 ' CE1' ' A' ' 699' ' ' TYR . 1.1 mm? -55.25 -49.05 73.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.919 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 705' ' ' SER . . . . . 0.64 ' O ' HD13 ' A' ' 709' ' ' LEU . 2.2 m -54.68 -55.68 27.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.299 179.675 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 706' ' ' TYR . . . . . 0.442 ' O ' HD21 ' A' ' 709' ' ' LEU . 14.3 t80 -47.44 -38.63 13.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.689 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -96.89 0.28 48.84 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -81.35 -19.71 42.19 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 709' ' ' LEU . . . . . 0.64 HD13 ' O ' ' A' ' 705' ' ' SER . 0.0 OUTLIER -92.27 -176.64 4.41 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.002 0.43 . . . . 0.0 111.458 -179.599 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 710' ' ' SER . . . . . 0.445 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.6 OUTLIER -84.7 168.59 20.19 Favored Pre-proline 0 C--N 1.331 -0.208 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.997 -179.804 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 711' ' ' PRO . . . . . 0.445 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 19.0 Cg_endo -59.01 -19.37 47.98 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.596 2.198 . . . . 0.0 112.569 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -59.36 -52.41 65.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.764 0.316 . . . . 0.0 110.73 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 713' ' ' GLU . . . . . 0.447 ' HB2' ' HG ' ' A' ' 709' ' ' LEU . 4.8 mm-40 -64.19 -25.69 68.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.842 179.56 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -74.42 -54.7 7.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.094 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.19 -34.78 79.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.394 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.08 -53.97 25.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.75 0.309 . . . . 0.0 111.045 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 717' ' ' LEU . . . . . 0.686 HD13 ' HB2' ' A' ' 632' ' ' HIS . 43.8 mt -65.4 -36.73 84.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.055 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 718' ' ' GLU . . . . . 0.581 ' HG2' HD22 ' A' ' 722' ' ' LEU . 37.2 tt0 -71.7 -54.22 11.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.482 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 2.5 mmtm -54.55 -30.91 55.39 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.207 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 720' ' ' GLU . . . . . 0.447 ' O ' ' HG2' ' A' ' 723' ' ' MET . 3.4 mm-40 -71.56 -55.8 7.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.991 0.424 . . . . 0.0 110.508 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 721' ' ' VAL . . . . . 0.539 HG23 ' O ' ' A' ' 717' ' ' LEU . 42.3 t -62.8 -50.75 78.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.915 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 722' ' ' LEU . . . . . 0.688 HD11 ' CG ' ' A' ' 624' ' ' GLN . 9.4 mp -56.93 -37.97 72.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.89 -179.24 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 723' ' ' MET . . . . . 0.551 ' O ' HD12 ' A' ' 727' ' ' ILE . 13.7 ptp -74.16 -39.13 63.46 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.26 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 724' ' ' GLU . . . . . 0.427 ' N ' ' HG3' ' A' ' 723' ' ' MET . 3.8 mt-10 -60.52 -31.0 70.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.057 -179.783 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 725' ' ' LYS . . . . . 0.417 ' HD2' ' CE2' ' A' ' 619' ' ' TRP . 9.5 pttt -86.09 -41.04 15.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.304 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -69.97 -50.6 40.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.155 -179.673 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 727' ' ' ILE . . . . . 0.784 HG23 ' HE3' ' A' ' 730' ' ' LYS . 4.2 mp -88.13 11.61 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.631 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 2.5 tt -57.8 -45.49 85.99 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.808 0.337 . . . . 0.0 111.058 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -60.7 -56.24 23.6 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.985 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 730' ' ' LYS . . . . . 0.784 ' HE3' HG23 ' A' ' 727' ' ' ILE . 28.5 mtmt . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.878 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 112.533 -0.227 . . . . 0.0 112.533 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -72.92 -35.11 5.8 Favored 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 122.591 2.194 . . . . 0.0 112.289 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 35.7 mt -65.25 159.99 22.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.963 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . -166.85 -51.85 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.408 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 61.25 94.66 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.817 0.341 . . . . 0.0 110.983 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 7.2 mt -100.35 -175.9 3.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.824 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -170.84 -104.77 0.18 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.59 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 617' ' ' ARG . . . . . 0.419 ' HG2' ' O ' ' A' ' 617' ' ' ARG . 0.0 OUTLIER -123.04 118.23 27.26 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-O 121.503 0.668 . . . . 0.0 110.879 -179.73 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.82 144.45 48.98 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.868 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 619' ' ' TRP . . . . . 0.457 ' CE2' ' HD2' ' A' ' 725' ' ' LYS . 0.1 OUTLIER -74.59 -7.05 51.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.43 179.969 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 116.63 158.25 11.24 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.438 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.81 -37.62 15.44 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.589 2.193 . . . . 0.0 112.048 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 622' ' ' ASN . . . . . 0.632 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 18.4 m-80 -67.73 -33.54 75.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.73 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 623' ' ' VAL . . . . . 0.451 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 60.5 t -70.15 -42.59 79.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.59 179.591 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 624' ' ' GLN . . . . . 0.406 ' OE1' HD12 ' A' ' 722' ' ' LEU . 42.6 tp60 -62.92 -38.11 89.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.46 179.609 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.37 -49.63 74.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.395 179.682 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 9.8 tt -67.7 -28.55 67.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.828 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -73.86 -49.21 26.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.139 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -58.81 -48.15 82.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.026 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 629' ' ' ILE . . . . . 0.55 HG22 HD11 ' A' ' 633' ' ' LEU . 20.5 mt -65.28 -38.84 83.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.984 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 630' ' ' LYS . . . . . 0.421 ' HA ' HD12 ' A' ' 633' ' ' LEU . 0.0 OUTLIER -62.02 -47.26 85.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.893 179.98 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -63.63 -40.22 96.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.984 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 632' ' ' HIS . . . . . 0.51 ' HB2' HD13 ' A' ' 717' ' ' LEU . 75.8 t60 -67.85 -42.89 80.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.858 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.598 HD13 ' SD ' ' A' ' 640' ' ' MET . 13.7 mt -56.58 -49.93 73.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.13 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -61.47 -41.54 97.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.67 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 11.8 t -73.56 -16.88 61.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.158 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 28.2 tp60 -93.72 -9.58 37.23 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.57 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 119.95 -10.08 11.19 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.576 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 638' ' ' ILE . . . . . 0.65 ' N ' HD12 ' A' ' 638' ' ' ILE . 3.3 mp -98.96 104.67 16.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.733 0.302 . . . . 0.0 111.114 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 1.2 m -77.18 113.12 14.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.889 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 640' ' ' MET . . . . . 0.598 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.9 mtp -128.37 31.01 5.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.887 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -62.89 -39.3 94.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.937 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -66.95 -77.83 0.07 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.001 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -176.43 140.96 0.53 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.839 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 644' ' ' PRO . . . . . 0.517 ' HB2' HD11 ' A' ' 651' ' ' LEU . 87.1 Cg_endo -78.23 147.95 23.71 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.604 2.203 . . . . 0.0 112.499 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 645' ' ' LEU . . . . . 0.689 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.8 tp -141.36 150.9 43.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.201 0.524 . . . . 0.0 111.159 179.677 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 646' ' ' ILE . . . . . 0.593 HD11 ' HA ' ' A' ' 695' ' ' LEU . 0.8 OUTLIER -149.58 132.99 7.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.634 179.004 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.04 41.02 59.43 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.339 -0.934 . . . . 0.0 112.176 -179.245 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 69.96 6.91 58.14 Favored Glycine 0 C--N 1.333 0.373 0 C-N-CA 120.969 -0.634 . . . . 0.0 113.786 179.317 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.8 m -131.23 162.13 30.69 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 117.372 0.586 . . . . 0.0 111.512 -179.131 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 650' ' ' GLU . . . . . 0.689 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.1 OUTLIER -77.92 144.04 37.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.773 179.775 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 651' ' ' LEU . . . . . 0.597 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -135.39 145.11 46.99 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.098 0.475 . . . . 0.0 111.296 -179.638 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -96.93 110.75 23.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.897 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 653' ' ' LEU . . . . . 0.415 ' HA ' HD13 ' A' ' 653' ' ' LEU . 3.5 mm? -52.19 -30.15 25.72 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.976 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 654' ' ' ALA . . . . . 0.632 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -71.69 -44.64 63.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.044 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 4.2 t -69.36 -34.42 74.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.547 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 656' ' ' PHE . . . . . 0.444 ' HD2' HD23 ' A' ' 651' ' ' LEU . 0.2 OUTLIER -71.29 -47.02 59.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.778 179.847 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 657' ' ' PHE . . . . . 0.457 ' HD1' HD21 ' A' ' 703' ' ' LEU . 89.4 t80 -56.83 -50.89 71.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.841 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 5.9 mtm180 -60.2 -41.63 93.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.718 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.66 -48.33 75.2 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.98 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 660' ' ' ILE . . . . . 0.742 HG21 ' HG2' ' A' ' 666' ' ' MET . 14.0 mt -59.94 -44.64 94.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.827 179.833 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 13.4 t30 -61.02 -44.43 97.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.888 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -67.14 -13.95 62.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.352 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 36.5 mmm -94.57 36.49 1.16 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.776 0.322 . . . . 0.0 111.102 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 65.04 44.24 94.64 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.588 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 81.51 172.73 47.21 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.549 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 666' ' ' MET . . . . . 0.742 ' HG2' HG21 ' A' ' 660' ' ' ILE . 0.0 OUTLIER -73.01 -31.66 64.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.744 0.307 . . . . 0.0 111.123 179.919 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 667' ' ' GLN . . . . . 0.405 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 12.6 pt20 -56.94 -44.09 82.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.185 -179.734 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 668' ' ' GLN . . . . . 0.415 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -64.87 -52.15 58.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.956 0.408 . . . . 0.0 110.842 -179.901 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 669' ' ' VAL . . . . . 0.654 HG21 HG23 ' A' ' 660' ' ' ILE . 80.4 t -49.25 -55.77 3.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.619 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 670' ' ' THR . . . . . 0.534 HG22 ' O ' ' A' ' 666' ' ' MET . 14.5 t -76.28 -50.29 14.76 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -178.572 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 671' ' ' ASP . . . . . 0.481 ' N ' HG23 ' A' ' 670' ' ' THR . 6.1 t0 -63.32 -51.25 66.79 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -177.546 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 672' ' ' LEU . . . . . 0.415 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 10.5 mp -76.68 2.68 13.48 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -178.918 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 48.89 85.62 0.03 OUTLIER 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.987 0.423 . . . . 0.0 110.494 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -147.13 22.07 1.21 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.209 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 675' ' ' TRP . . . . . 1.152 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 38.1 m95 -60.15 -27.47 67.11 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 121.358 0.599 . . . . 0.0 110.16 179.757 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -55.44 -44.36 76.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.714 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 12.1 mttm -77.08 -51.6 10.76 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 120.748 0.309 . . . . 0.0 111.539 -179.336 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 1.012 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.43 -40.94 72.15 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 109.786 -0.449 . . . . 0.0 109.786 179.694 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 679' ' ' ALA . . . . . 0.827 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.62 -35.06 70.33 Favored 'General case' 0 C--N 1.334 -0.073 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.828 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -53.21 -47.64 68.78 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.504 179.702 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -19.19 65.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.066 179.628 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 682' ' ' LEU . . . . . 0.495 HD23 ' O ' ' A' ' 678' ' ' LEU . 3.2 mm? -80.99 -2.8 49.35 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.632 -179.89 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 683' ' ' ARG . . . . . 0.771 ' C ' HD12 ' A' ' 684' ' ' ILE . 8.4 mmm180 73.68 71.88 0.12 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.869 0.366 . . . . 0.0 111.465 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 684' ' ' ILE . . . . . 0.771 HD12 ' C ' ' A' ' 683' ' ' ARG . 3.2 mp -134.25 138.46 30.41 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.323 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 685' ' ' PRO . . . . . 0.542 ' HD2' HG23 ' A' ' 684' ' ' ILE . 28.1 Cg_endo -63.0 125.35 15.7 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.498 2.132 . . . . 0.0 112.763 -179.514 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -69.96 -23.9 63.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.023 179.589 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.36 -23.93 67.11 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.289 -179.655 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -71.34 109.16 5.17 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.826 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -70.79 -68.88 0.4 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.971 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -52.52 -18.53 1.75 Allowed 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 691' ' ' ARG . . . . . 0.439 ' HD3' HD22 ' A' ' 692' ' ' LEU . 0.0 OUTLIER -50.25 -33.96 21.48 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.795 0.331 . . . . 0.0 110.779 179.764 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 692' ' ' LEU . . . . . 0.439 HD22 ' HD3' ' A' ' 691' ' ' ARG . 4.3 mm? -70.27 -48.04 58.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.913 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.1 -38.41 69.36 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.316 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 2.7 tptt -61.71 -40.63 95.7 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.088 0.47 . . . . 0.0 110.117 179.625 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 1.152 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.3 OUTLIER -66.89 -43.79 82.54 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.399 179.551 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.49 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 5.2 tp60 -55.42 -46.91 76.63 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.76 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -77.18 -29.37 54.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.753 179.591 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 698' ' ' ALA . . . . . 0.429 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -68.1 -40.58 82.57 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.64 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 699' ' ' TYR . . . . . 0.498 ' CD2' ' CZ2' ' A' ' 675' ' ' TRP . 0.7 OUTLIER -84.16 -31.13 25.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.955 0.407 . . . . 0.0 110.657 -179.94 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 700' ' ' CYS . . . . . 0.451 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 41.7 t -67.69 -30.4 69.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.877 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.14 -1.78 33.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.787 -179.684 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 702' ' ' TYR . . . . . 0.439 ' CE2' HG21 ' A' ' 638' ' ' ILE . 4.3 m-85 -115.55 -78.85 0.58 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.809 0.337 . . . . 0.0 111.7 -179.508 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 703' ' ' LEU . . . . . 0.457 HD21 ' HD1' ' A' ' 657' ' ' PHE . 2.7 tp -63.2 -38.85 92.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.829 -179.04 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.451 ' HB2' ' O ' ' A' ' 700' ' ' CYS . 0.6 OUTLIER -50.83 -56.66 11.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.471 -179.557 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 22.7 p -54.42 -49.32 70.23 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.173 -179.676 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 706' ' ' TYR . . . . . 0.637 ' O ' HD22 ' A' ' 709' ' ' LEU . 10.5 t80 -62.36 -29.14 70.25 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.345 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -96.8 -1.27 46.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.823 -179.563 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 1.5 t -112.31 -18.18 12.56 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.603 0.239 . . . . 0.0 111.501 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 709' ' ' LEU . . . . . 0.637 HD22 ' O ' ' A' ' 706' ' ' TYR . 0.2 OUTLIER -74.09 175.19 7.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.759 0.314 . . . . 0.0 110.992 -179.918 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.44 166.15 47.4 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.228 -179.761 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -67.94 -27.45 36.69 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.646 2.23 . . . . 0.0 112.119 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -52.2 -50.51 61.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.633 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 713' ' ' GLU . . . . . 0.462 ' HB2' ' CD1' ' A' ' 709' ' ' LEU . 3.3 mm-40 -58.08 -26.6 62.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.193 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 714' ' ' HIS . . . . . 0.581 ' CD2' HD21 ' A' ' 709' ' ' LEU . 5.6 m170 -75.88 -53.62 8.17 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.935 0.398 . . . . 0.0 110.61 179.732 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 4.4 tpp180 -59.78 -45.32 92.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.385 -179.647 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -54.23 31.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.443 -179.452 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 717' ' ' LEU . . . . . 0.51 HD13 ' HB2' ' A' ' 632' ' ' HIS . 71.2 mt -62.04 -44.06 97.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.816 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -64.72 -53.78 41.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.164 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 6.7 mmtt -50.15 -34.22 21.63 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.152 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 720' ' ' GLU . . . . . 0.437 ' O ' ' HG2' ' A' ' 723' ' ' MET . 1.1 mm-40 -68.16 -55.47 12.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.012 0.434 . . . . 0.0 110.404 179.521 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 31.3 t -62.84 -54.98 26.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.977 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 722' ' ' LEU . . . . . 0.406 HD12 ' OE1' ' A' ' 624' ' ' GLN . 1.2 mp -49.0 -43.76 40.52 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.765 -179.312 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 723' ' ' MET . . . . . 0.698 ' O ' HD12 ' A' ' 727' ' ' ILE . 17.4 ptp -73.6 -41.31 63.01 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.456 -0.498 . . . . 0.0 109.792 179.416 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -57.37 -29.47 64.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.461 -179.66 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 725' ' ' LYS . . . . . 0.457 ' HD2' ' CE2' ' A' ' 619' ' ' TRP . 9.4 ptmm? -86.02 -38.88 17.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.329 -179.694 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 726' ' ' GLU . . . . . 0.403 ' N ' ' HG3' ' A' ' 725' ' ' LYS . 1.7 mm-40 -71.3 -49.92 37.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.017 -179.782 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 727' ' ' ILE . . . . . 0.698 HD12 ' O ' ' A' ' 723' ' ' MET . 3.7 mp -88.36 11.45 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.629 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 1.6 tt -58.77 -49.48 77.49 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.824 0.345 . . . . 0.0 110.94 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -71.89 -46.1 58.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 10.3 mtpt . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.878 -179.965 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.234 0 N-CA-C 112.502 -0.239 . . . . 0.0 112.502 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -68.91 -27.96 30.03 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.589 2.193 . . . . 0.0 112.269 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 6.9 mt -66.26 168.21 9.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.92 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 73.4 44.98 31.81 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.487 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -158.27 60.54 0.45 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.859 0.361 . . . . 0.0 110.868 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 7.1 mt -77.63 170.91 15.75 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.869 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 616' ' ' GLY . . . . . 0.404 ' O ' ' HD3' ' A' ' 617' ' ' ARG . . . 111.76 70.59 0.59 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.492 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 617' ' ' ARG . . . . . 0.404 ' HD3' ' O ' ' A' ' 616' ' ' GLY . 76.2 mmt-85 -139.24 120.65 14.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.164 0.507 . . . . 0.0 110.572 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.7 126.28 5.6 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.927 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 619' ' ' TRP . . . . . 0.535 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.0 OUTLIER -63.09 -17.43 62.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.183 179.95 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 119.0 166.12 13.36 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.495 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -67.54 -36.49 19.64 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.508 2.139 . . . . 0.0 112.127 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -65.01 -42.17 94.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.842 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 623' ' ' VAL . . . . . 0.458 HG21 ' HB2' ' A' ' 619' ' ' TRP . 47.4 t -68.53 -37.09 77.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.926 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 624' ' ' GLN . . . . . 0.509 ' CG ' HD21 ' A' ' 722' ' ' LEU . 1.3 tm0? -62.1 -41.81 98.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.8 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.64 -47.03 76.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.679 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 7.1 tt -67.07 -26.62 66.82 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.96 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 627' ' ' ALA . . . . . 0.475 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -73.95 -54.06 8.74 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.363 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 30.8 p -57.92 -41.83 83.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.03 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 29.0 mt -69.28 -42.52 81.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.816 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.48 -43.87 98.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.765 179.801 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 1.6 tttm -63.01 -42.21 99.78 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.852 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 632' ' ' HIS . . . . . 0.64 ' HB2' HD13 ' A' ' 717' ' ' LEU . 77.8 t60 -67.41 -42.4 83.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.898 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.644 HD13 ' SD ' ' A' ' 640' ' ' MET . 58.0 mt -55.9 -49.48 73.3 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.338 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 634' ' ' ARG . . . . . 0.49 ' HG3' ' N ' ' A' ' 635' ' ' SER . 0.0 OUTLIER -64.22 -40.44 96.05 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.937 -179.972 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 635' ' ' SER . . . . . 0.49 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 0.1 OUTLIER -73.89 -16.09 61.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.142 179.765 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 636' ' ' GLN . . . . . 0.444 ' CG ' ' CE1' ' A' ' 632' ' ' HIS . 9.8 mm100 -94.44 -10.23 33.07 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.564 -179.669 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 120.22 -11.97 10.58 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.573 -0.822 . . . . 0.0 112.522 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 638' ' ' ILE . . . . . 0.456 HG21 ' CE2' ' A' ' 702' ' ' TYR . 5.3 mp -94.25 104.7 16.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 120.668 0.27 . . . . 0.0 111.194 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.42 109.08 15.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.844 0.354 . . . . 0.0 110.994 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 640' ' ' MET . . . . . 0.644 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.4 mtp -119.13 28.89 7.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.891 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -66.68 -31.84 72.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.888 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -72.73 -78.61 0.09 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.878 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 1.3 pp -178.87 126.79 0.26 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.947 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -75.54 131.03 13.26 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.459 2.106 . . . . 0.0 112.274 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 645' ' ' LEU . . . . . 0.445 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.1 tp -126.43 152.47 46.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.206 0.527 . . . . 0.0 111.13 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 646' ' ' ILE . . . . . 0.664 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.2 tt -149.57 133.26 8.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.832 179.174 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 54.15 38.87 62.27 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.239 -0.981 . . . . 0.0 111.93 -179.237 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.45 7.55 60.97 Favored Glycine 0 CA--C 1.52 0.389 0 C-N-CA 121.085 -0.579 . . . . 0.0 113.626 179.498 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 11.0 m -133.82 164.15 27.9 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 117.366 0.583 . . . . 0.0 111.557 -179.085 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 650' ' ' GLU . . . . . 0.445 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.2 OUTLIER -78.92 145.75 33.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.761 179.694 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 651' ' ' LEU . . . . . 0.613 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.94 145.05 47.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.406 -179.745 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -96.9 111.76 23.82 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.984 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 653' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 653' ' ' LEU . 3.8 mm? -53.06 -35.49 59.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.097 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -67.88 -46.19 72.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.231 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 4.7 t -69.15 -38.22 78.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.608 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 656' ' ' PHE . . . . . 0.48 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.3 OUTLIER -68.73 -47.25 66.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.892 179.813 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -60.33 -50.97 71.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.011 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -56.03 -43.44 77.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.102 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 659' ' ' LEU . . . . . 0.825 HD13 ' CD2' ' A' ' 682' ' ' LEU . 0.2 OUTLIER -57.68 -47.55 82.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.17 -179.782 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 660' ' ' ILE . . . . . 0.695 HG23 HG21 ' A' ' 669' ' ' VAL . 24.7 mt -56.87 -45.09 83.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.8 0.333 . . . . 0.0 110.825 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -62.41 -44.97 95.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.726 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -66.84 -14.13 62.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.251 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 663' ' ' MET . . . . . 0.404 ' CE ' ' HB3' ' A' ' 678' ' ' LEU . 0.0 OUTLIER -94.93 36.44 1.2 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.718 0.294 . . . . 0.0 110.979 -179.913 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 68.97 35.65 79.51 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.658 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 84.02 172.46 48.94 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.542 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 666' ' ' MET . . . . . 0.632 ' O ' HG22 ' A' ' 670' ' ' THR . 9.0 tpt -70.99 -28.94 64.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.66 0.267 . . . . 0.0 111.041 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 667' ' ' GLN . . . . . 0.442 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 12.4 pt20 -57.21 -43.74 83.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.25 -179.728 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 668' ' ' GLN . . . . . 0.431 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -66.63 -52.69 42.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.941 0.4 . . . . 0.0 110.913 179.979 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 669' ' ' VAL . . . . . 0.695 HG21 HG23 ' A' ' 660' ' ' ILE . 53.2 t -49.37 -55.65 3.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.627 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 670' ' ' THR . . . . . 0.632 HG22 ' O ' ' A' ' 666' ' ' MET . 14.9 t -76.39 -48.89 18.26 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 113.857 1.058 . . . . 0.0 113.857 -178.474 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 671' ' ' ASP . . . . . 0.458 ' N ' HG23 ' A' ' 670' ' ' THR . 17.5 t0 -65.65 -51.22 61.25 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -177.679 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 672' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 8.7 mp -76.92 3.24 12.56 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 -179.154 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 49.22 84.47 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.962 0.41 . . . . 0.0 110.426 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 1.9 ttmt -144.72 21.86 1.63 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.263 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 675' ' ' TRP . . . . . 1.149 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 36.3 m95 -60.26 -28.52 68.13 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.369 0.604 . . . . 0.0 110.089 179.694 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -55.64 -44.51 77.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.643 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 1.7 ttpt -76.85 -51.55 11.09 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 120.704 0.287 . . . . 0.0 111.634 -179.3 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 1.006 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.56 -41.84 73.83 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 179.798 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 679' ' ' ALA . . . . . 0.79 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.48 -34.18 69.94 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-O 120.875 0.369 . . . . 0.0 110.521 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.34 -46.35 69.47 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.389 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 4.9 ttm -65.52 -21.05 66.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.837 179.399 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 682' ' ' LEU . . . . . 0.825 ' CD2' HD13 ' A' ' 659' ' ' LEU . 2.7 mm? -79.96 -1.4 39.34 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.428 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 683' ' ' ARG . . . . . 0.795 ' C ' HD12 ' A' ' 684' ' ' ILE . 1.8 mpt_? 72.1 71.85 0.16 Allowed 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.959 0.409 . . . . 0.0 111.37 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 684' ' ' ILE . . . . . 0.795 HD12 ' C ' ' A' ' 683' ' ' ARG . 3.1 mp -133.57 138.28 30.78 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.328 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 685' ' ' PRO . . . . . 0.525 ' HD2' HG23 ' A' ' 684' ' ' ILE . 21.7 Cg_endo -61.68 125.3 16.36 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.591 2.194 . . . . 0.0 112.679 -179.514 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.86 -26.03 64.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.954 179.612 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.52 -23.84 66.98 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.224 -179.817 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -68.96 109.15 3.8 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.916 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -71.74 -68.93 0.42 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.889 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -51.4 -21.28 2.2 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.771 -179.578 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 691' ' ' ARG . . . . . 0.503 ' NH2' ' HB3' ' A' ' 679' ' ' ALA . 0.0 OUTLIER -49.87 -35.22 22.6 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.881 0.372 . . . . 0.0 110.687 179.677 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 692' ' ' LEU . . . . . 0.448 HD22 ' NE ' ' A' ' 691' ' ' ARG . 4.5 mm? -70.41 -47.21 61.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.074 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.13 -39.14 69.04 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.451 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 7.1 mttp -61.87 -41.32 97.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.09 0.471 . . . . 0.0 110.255 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 1.149 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.4 OUTLIER -67.32 -43.91 80.46 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.471 179.784 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.443 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 1.3 tt0 -55.24 -46.22 76.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.87 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -77.56 -29.69 52.31 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.074 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 698' ' ' ALA . . . . . 0.42 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.38 -39.25 85.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.544 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 699' ' ' TYR . . . . . 0.528 ' CZ ' ' HE2' ' A' ' 666' ' ' MET . 1.0 OUTLIER -84.99 -32.56 22.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.928 0.394 . . . . 0.0 110.512 179.881 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 700' ' ' CYS . . . . . 0.574 ' HA ' HD23 ' A' ' 704' ' ' LEU . 1.7 m -65.21 -30.28 71.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.714 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -100.91 -1.9 33.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.615 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 702' ' ' TYR . . . . . 0.456 ' CE2' HG21 ' A' ' 638' ' ' ILE . 4.8 m-85 -116.33 -79.59 0.59 Allowed 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 120.813 0.34 . . . . 0.0 111.524 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 1.6 tp -61.52 -40.51 94.89 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.722 -179.206 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.574 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.4 OUTLIER -48.31 -56.94 6.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.886 0.374 . . . . 0.0 111.429 -179.566 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 12.9 p -54.63 -47.33 73.61 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.383 -179.656 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 706' ' ' TYR . . . . . 0.63 ' O ' HD22 ' A' ' 709' ' ' LEU . 10.2 t80 -66.13 -29.44 69.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.591 -179.503 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -96.71 -0.09 48.8 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 6.9 t -116.92 -15.77 10.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.541 0.21 . . . . 0.0 111.523 -179.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 709' ' ' LEU . . . . . 0.63 HD22 ' O ' ' A' ' 706' ' ' TYR . 0.2 OUTLIER -73.96 175.14 7.65 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.751 0.31 . . . . 0.0 110.934 -179.949 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.41 164.51 59.14 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.958 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -66.5 -30.88 43.01 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.604 2.203 . . . . 0.0 111.961 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -48.94 -50.2 36.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.831 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 713' ' ' GLU . . . . . 0.449 ' HB2' ' CD1' ' A' ' 709' ' ' LEU . 3.5 mm-40 -58.26 -29.35 65.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.891 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 714' ' ' HIS . . . . . 0.485 ' CD2' ' CE1' ' A' ' 706' ' ' TYR . 1.8 m170 -75.76 -53.96 7.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.497 179.485 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 1.9 mtp-105 -60.22 -47.79 84.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.38 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.06 -54.05 40.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.553 -179.369 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 717' ' ' LEU . . . . . 0.64 HD13 ' HB2' ' A' ' 632' ' ' HIS . 84.8 mt -62.89 -42.38 99.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.128 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 718' ' ' GLU . . . . . 0.633 ' HG3' HD23 ' A' ' 722' ' ' LEU . 28.4 tt0 -67.37 -54.22 22.5 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.502 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -51.04 -33.66 26.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.323 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 720' ' ' GLU . . . . . 0.412 ' O ' ' HG2' ' A' ' 723' ' ' MET . 0.2 OUTLIER -69.42 -55.68 9.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.974 0.416 . . . . 0.0 110.563 179.8 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 721' ' ' VAL . . . . . 0.535 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 23.3 t -63.44 -54.94 26.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.143 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 722' ' ' LEU . . . . . 0.724 HD13 ' HE2' ' A' ' 725' ' ' LYS . 3.6 mm? -50.36 -43.29 54.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.779 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 723' ' ' MET . . . . . 0.62 ' HB2' HD13 ' A' ' 727' ' ' ILE . 13.4 ptp -72.12 -40.53 68.04 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.079 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 724' ' ' GLU . . . . . 0.429 ' N ' ' HG3' ' A' ' 723' ' ' MET . 2.2 mt-10 -52.41 -37.7 57.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.272 -179.727 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 725' ' ' LYS . . . . . 0.724 ' HE2' HD13 ' A' ' 722' ' ' LEU . 0.0 OUTLIER -86.05 -45.71 11.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.227 -179.786 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -59.67 -55.75 30.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.199 -179.709 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 727' ' ' ILE . . . . . 0.642 ' O ' HG22 ' A' ' 727' ' ' ILE . 4.2 mp -88.73 11.76 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.591 -179.811 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 7.3 tt -48.93 -31.73 7.82 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.757 0.313 . . . . 0.0 111.213 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -61.09 -46.21 91.57 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.858 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 730' ' ' LYS . . . . . 0.463 ' HB2' HG22 ' A' ' 727' ' ' ILE . 1.6 mtpt . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.208 -0.901 . . . . 0.0 110.807 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.193 0 CA-C-O 120.143 -0.254 . . . . 0.0 112.487 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_exo -51.59 -44.65 42.76 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.425 2.084 . . . . 0.0 112.293 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.2 mp -79.67 165.16 23.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.873 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . -135.26 -141.53 4.4 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.498 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -96.8 79.1 2.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.861 0.363 . . . . 0.0 110.914 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 11.4 mt -128.3 175.73 8.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.863 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 117.91 -53.59 0.64 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.539 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 19.8 mmm180 -129.67 -145.97 0.3 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.371 -0.233 . . . . 0.0 110.371 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 5.1 mtp85 -61.95 121.49 13.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.781 0.324 . . . . 0.0 110.9 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 619' ' ' TRP . . . . . 0.629 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.1 OUTLIER -63.17 -16.82 61.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.347 -179.993 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 117.84 160.16 11.55 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.45 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -67.08 -33.73 30.81 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.57 2.18 . . . . 0.0 112.081 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 622' ' ' ASN . . . . . 0.441 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 19.5 m-80 -68.13 -34.8 77.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.813 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 623' ' ' VAL . . . . . 0.446 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 56.1 t -71.11 -45.32 72.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.582 179.576 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 624' ' ' GLN . . . . . 0.491 ' HG2' HD11 ' A' ' 722' ' ' LEU . 34.9 tp60 -59.47 -37.84 79.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.42 179.573 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.84 -50.75 69.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.256 179.431 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 9.3 tt -67.78 -28.69 67.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.712 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -72.03 -51.32 22.33 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.09 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.13 -47.85 80.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.935 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 629' ' ' ILE . . . . . 0.494 HG22 ' CD1' ' A' ' 633' ' ' LEU . 38.8 mt -63.63 -37.58 80.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.828 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp -63.88 -47.52 80.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.79 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 5.3 tttm -60.28 -40.1 89.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.875 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 632' ' ' HIS . . . . . 0.855 ' CD2' HD11 ' A' ' 709' ' ' LEU . 21.4 t-80 -70.87 -42.82 69.57 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.986 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.598 HD13 ' SD ' ' A' ' 640' ' ' MET . 20.1 mt -57.63 -50.06 74.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.222 -179.692 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 3.3 ptt85 -62.96 -44.12 96.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.817 0.341 . . . . 0.0 110.822 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.69 -11.56 60.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.221 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 636' ' ' GLN . . . . . 0.556 ' HG3' ' CE1' ' A' ' 632' ' ' HIS . 23.4 mm-40 -97.2 -7.84 31.43 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.572 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 111.89 6.75 24.32 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.375 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 638' ' ' ILE . . . . . . . . . . . . . 18.0 mt -117.03 107.86 23.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 CA-C-O 120.679 0.276 . . . . 0.0 111.318 -179.157 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -82.55 113.61 20.39 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.865 0.364 . . . . 0.0 110.791 179.743 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 640' ' ' MET . . . . . 0.598 ' SD ' HD13 ' A' ' 633' ' ' LEU . 2.0 ttp -124.15 35.45 4.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.883 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -69.53 -31.82 70.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.038 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 642' ' ' GLU . . . . . 0.415 ' O ' HD12 ' A' ' 643' ' ' LEU . 4.6 mm-40 -70.84 -79.01 0.07 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.971 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 643' ' ' LEU . . . . . 0.415 HD12 ' O ' ' A' ' 642' ' ' GLU . 0.1 OUTLIER -178.97 135.02 0.29 Allowed Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.845 179.964 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 644' ' ' PRO . . . . . 0.494 ' HB2' HD11 ' A' ' 651' ' ' LEU . 72.0 Cg_endo -74.69 138.61 24.07 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.523 2.149 . . . . 0.0 112.29 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 645' ' ' LEU . . . . . 0.655 HD12 ' HA ' ' A' ' 650' ' ' GLU . 5.0 tp -131.31 149.96 52.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.171 0.51 . . . . 0.0 111.134 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 646' ' ' ILE . . . . . 0.742 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.2 tt -146.84 131.8 11.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.568 178.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 52.36 44.2 58.23 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.283 -0.961 . . . . 0.0 112.226 -179.235 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 66.27 8.7 45.65 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 120.925 -0.655 . . . . 0.0 113.773 179.463 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 33.3 m -131.15 161.95 30.99 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 117.374 0.587 . . . . 0.0 111.377 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 650' ' ' GLU . . . . . 0.655 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.6 OUTLIER -80.09 143.53 33.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.768 179.897 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 651' ' ' LEU . . . . . 0.612 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -135.35 145.24 47.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.29 -179.692 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -97.33 110.79 23.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.886 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -52.14 -43.58 64.12 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.128 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 654' ' ' ALA . . . . . 0.441 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -60.89 -43.31 98.63 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.153 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 1.6 t -66.5 -35.5 80.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.803 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 656' ' ' PHE . . . . . 0.499 ' HD2' HD23 ' A' ' 651' ' ' LEU . 0.1 OUTLIER -72.78 -43.61 62.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.938 -179.98 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -59.7 -46.62 88.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.854 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 37.8 mtp180 -63.57 -43.87 95.77 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.048 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 659' ' ' LEU . . . . . 0.794 HD13 ' CD2' ' A' ' 682' ' ' LEU . 0.2 OUTLIER -59.36 -49.55 77.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.359 -179.67 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 660' ' ' ILE . . . . . 0.569 HD11 ' CH2' ' A' ' 675' ' ' TRP . 41.4 mt -56.83 -45.97 83.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.721 0.296 . . . . 0.0 110.889 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -66.88 -46.24 75.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.163 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -56.32 -21.38 23.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.548 -179.653 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.86 28.64 1.76 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.627 -0.26 . . . . 0.0 111.31 -179.765 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 90.49 -16.85 56.82 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.78 179.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 135.79 179.43 16.6 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.32 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 666' ' ' MET . . . . . 0.535 ' O ' HG22 ' A' ' 670' ' ' THR . 0.0 OUTLIER -72.64 -40.63 66.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.741 0.305 . . . . 0.0 111.199 -179.954 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 667' ' ' GLN . . . . . 0.404 ' HG2' ' N ' ' A' ' 668' ' ' GLN . 6.6 pm0 -51.13 -43.64 61.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.457 -179.548 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 668' ' ' GLN . . . . . 0.404 ' N ' ' HG2' ' A' ' 667' ' ' GLN . 0.0 OUTLIER -64.8 -52.44 56.82 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.879 0.371 . . . . 0.0 110.925 -179.926 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 669' ' ' VAL . . . . . 0.483 ' HB ' ' HE1' ' A' ' 666' ' ' MET . 89.5 t -49.33 -54.15 6.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.524 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 670' ' ' THR . . . . . 0.535 HG22 ' O ' ' A' ' 666' ' ' MET . 9.6 t -76.18 -54.3 7.01 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -178.563 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 671' ' ' ASP . . . . . 0.503 ' N ' HG23 ' A' ' 670' ' ' THR . 69.7 m-20 -56.88 -51.18 70.09 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -177.88 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 672' ' ' LEU . . . . . 0.404 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 7.9 mp -77.88 1.62 19.9 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -179.068 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 48.98 83.48 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.951 0.405 . . . . 0.0 110.439 -179.845 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 4.9 mtpm? -144.79 21.51 1.63 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.288 -179.584 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 675' ' ' TRP . . . . . 1.117 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 35.1 m95 -58.34 -29.16 65.72 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 121.338 0.589 . . . . 0.0 110.049 179.654 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 676' ' ' ASN . . . . . 0.414 ' CG ' HD11 ' A' ' 692' ' ' LEU . 15.5 m-80 -56.8 -41.27 77.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.676 -179.622 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 9.1 mttt -78.54 -51.95 9.2 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 120.774 0.321 . . . . 0.0 111.565 -179.353 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 1.012 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -56.77 -40.72 76.33 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 179.404 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 679' ' ' ALA . . . . . 0.796 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.94 -31.84 66.73 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.301 178.746 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.28 -48.18 68.53 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.038 179.379 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -62.04 -23.8 66.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.794 179.397 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 682' ' ' LEU . . . . . 0.794 ' CD2' HD13 ' A' ' 659' ' ' LEU . 3.0 mm? -79.59 -2.42 42.42 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.507 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 683' ' ' ARG . . . . . 0.775 ' C ' HD12 ' A' ' 684' ' ' ILE . 6.3 mmm180 70.49 72.01 0.21 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.933 0.397 . . . . 0.0 111.443 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 684' ' ' ILE . . . . . 0.775 HD12 ' C ' ' A' ' 683' ' ' ARG . 2.4 mp -128.52 141.78 42.63 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.456 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 685' ' ' PRO . . . . . 0.664 ' HD2' HG23 ' A' ' 684' ' ' ILE . 38.1 Cg_endo -68.16 121.33 8.31 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.261 1.974 . . . . 0.0 112.05 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -70.54 -25.08 62.94 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.432 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.37 -18.52 65.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.595 -179.515 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 688' ' ' ALA . . . . . 0.483 ' HB3' ' HB2' ' A' ' 691' ' ' ARG . . . -77.1 111.91 13.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.774 0.321 . . . . 0.0 111.425 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -83.17 -7.6 59.6 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.455 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -97.67 -27.58 14.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.148 0.499 . . . . 0.0 109.926 179.001 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 691' ' ' ARG . . . . . 0.483 ' HB2' ' HB3' ' A' ' 688' ' ' ALA . 0.3 OUTLIER -52.39 -46.72 66.38 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.32 -179.641 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 692' ' ' LEU . . . . . 0.451 ' HA ' HD13 ' A' ' 692' ' ' LEU . 3.8 mm? -59.74 -46.2 89.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.299 -179.658 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.42 -39.49 67.87 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.823 0.344 . . . . 0.0 111.411 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.39 -41.93 93.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.453 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 1.117 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 1.1 tp -64.7 -44.67 89.51 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.544 179.744 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.453 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 2.2 mm-40 -55.55 -47.75 75.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.879 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -76.41 -29.45 57.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.211 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 698' ' ' ALA . . . . . 0.402 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.56 -37.1 82.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.721 -179.648 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 699' ' ' TYR . . . . . 0.493 ' CZ ' ' HE3' ' A' ' 666' ' ' MET . 1.3 p90 -85.38 -36.83 20.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.932 0.396 . . . . 0.0 110.394 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 700' ' ' CYS . . . . . . . . . . . . . 5.3 m -62.77 -30.47 71.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.546 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -95.89 -4.93 42.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.392 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 702' ' ' TYR . . . . . 0.459 ' CD2' HD21 ' A' ' 633' ' ' LEU . 6.8 m-85 -121.56 -75.47 0.59 Allowed 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.838 0.352 . . . . 0.0 111.257 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -54.01 -48.91 69.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.476 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.424 HD23 ' CE1' ' A' ' 699' ' ' TYR . 1.3 mm? -54.9 -29.57 56.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.099 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 24.5 m -69.74 -55.4 10.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.424 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 706' ' ' TYR . . . . . 0.414 ' HA ' HD12 ' A' ' 709' ' ' LEU . 68.8 t80 -62.8 -29.57 70.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.931 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -85.5 -17.48 36.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.317 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 4.4 m -90.73 -21.91 21.35 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.84 0.352 . . . . 0.0 111.05 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 709' ' ' LEU . . . . . 0.855 HD11 ' CD2' ' A' ' 632' ' ' HIS . 60.6 mt -56.53 146.4 25.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.371 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 710' ' ' SER . . . . . 0.439 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.4 OUTLIER -79.39 167.67 32.56 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.607 179.732 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 711' ' ' PRO . . . . . 0.439 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 9.9 Cg_endo -53.15 -23.06 21.3 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.631 2.221 . . . . 0.0 112.401 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -70.18 -55.21 9.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.852 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 713' ' ' GLU . . . . . 0.562 ' O ' HD12 ' A' ' 717' ' ' LEU . 1.6 mm-40 -63.2 -25.95 68.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.845 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 9.9 m-70 -75.68 -54.69 6.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.116 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -64.9 -38.04 89.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.14 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 33.3 ttt180 -68.19 -54.11 20.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.104 -179.808 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 717' ' ' LEU . . . . . 0.596 ' O ' HG23 ' A' ' 721' ' ' VAL . 35.0 mt -64.58 -37.61 88.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.802 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 718' ' ' GLU . . . . . 0.401 ' O ' ' HB2' ' A' ' 722' ' ' LEU . 31.9 tt0 -71.24 -54.24 11.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.557 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 1.5 mmtt -52.4 -32.46 39.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.771 0.319 . . . . 0.0 111.191 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 720' ' ' GLU . . . . . 0.44 ' O ' ' HG2' ' A' ' 723' ' ' MET . 0.5 OUTLIER -70.02 -55.73 8.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.032 0.444 . . . . 0.0 110.468 179.652 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 721' ' ' VAL . . . . . 0.629 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 21.7 t -63.43 -53.49 44.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.183 -179.723 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 722' ' ' LEU . . . . . 0.491 HD11 ' HG2' ' A' ' 624' ' ' GLN . 1.2 mp -53.12 -41.0 64.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.998 -179.352 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 723' ' ' MET . . . . . 0.575 ' O ' HD12 ' A' ' 727' ' ' ILE . 14.0 ptp -72.0 -38.75 69.6 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.101 179.745 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 40.7 mm-40 -57.33 -33.64 67.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.117 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 725' ' ' LYS . . . . . 0.457 ' HD2' ' CE2' ' A' ' 619' ' ' TRP . 0.0 OUTLIER -86.14 -38.83 17.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.367 -179.704 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -68.41 -50.18 54.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.841 0.353 . . . . 0.0 111.13 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 727' ' ' ILE . . . . . 0.653 ' O ' HG22 ' A' ' 727' ' ' ILE . 4.3 mp -88.2 11.47 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.551 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 3.4 tt -59.49 -35.43 74.11 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.867 0.365 . . . . 0.0 110.906 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -79.86 -71.07 0.47 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.991 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 730' ' ' LYS . . . . . 0.546 ' HG3' HG23 ' A' ' 727' ' ' ILE . 13.1 ptmt . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.917 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.206 0 N-CA-C 112.411 -0.276 . . . . 0.0 112.411 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -51.99 -28.56 32.5 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.535 2.157 . . . . 0.0 112.342 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 612' ' ' LEU . . . . . 0.542 HD23 HD12 ' A' ' 615' ' ' LEU . 4.6 mp -62.94 169.51 3.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.927 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . -112.08 -120.35 3.85 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.49 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -98.79 31.42 2.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.815 0.34 . . . . 0.0 110.895 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 615' ' ' LEU . . . . . 0.542 HD12 HD23 ' A' ' 612' ' ' LEU . 60.1 mt -68.47 -176.75 0.81 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.831 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 151.23 -52.38 0.5 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.52 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 5.0 mmm180 -109.94 -143.66 0.39 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.46 0.171 . . . . 0.0 110.593 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 60.8 mtt180 -56.27 137.79 51.62 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.864 0.364 . . . . 0.0 111.205 -179.781 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 619' ' ' TRP . . . . . 0.614 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.1 OUTLIER -72.78 -10.42 59.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.349 179.915 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 116.6 160.52 12.07 Favored Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.433 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -68.21 -39.03 10.97 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.541 2.161 . . . . 0.0 112.222 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 10.8 p30 -66.24 -34.22 77.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.885 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 623' ' ' VAL . . . . . 0.445 HG11 ' HB2' ' A' ' 619' ' ' TRP . 44.1 t -68.19 -45.65 82.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.712 179.669 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 624' ' ' GLN . . . . . 0.513 ' HG2' HD11 ' A' ' 722' ' ' LEU . 41.2 tp60 -60.95 -39.61 90.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.543 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 625' ' ' ARG . . . . . 0.484 ' O ' HD12 ' A' ' 629' ' ' ILE . 0.0 OUTLIER -59.52 -50.82 72.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.57 179.702 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 6.7 tt -68.51 -29.71 68.36 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.871 179.777 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -70.24 -50.27 41.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.373 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.5 -37.1 85.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.346 -179.646 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 629' ' ' ILE . . . . . 0.523 HD13 ' HB3' ' A' ' 653' ' ' LEU . 38.7 mt -63.86 -54.01 37.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.327 -179.746 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 630' ' ' LYS . . . . . 0.559 ' HB3' ' HE1' ' A' ' 640' ' ' MET . 0.9 OUTLIER -61.69 -32.41 72.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.269 -179.71 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 631' ' ' LYS . . . . . 0.425 ' N ' ' HG3' ' A' ' 630' ' ' LYS . 1.8 tttm -63.1 -50.96 68.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.84 0.352 . . . . 0.0 111.329 -179.704 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 632' ' ' HIS . . . . . 0.596 ' HB3' HD13 ' A' ' 717' ' ' LEU . 3.5 p-80 -68.31 -39.7 81.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.712 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.463 ' N ' ' CD2' ' A' ' 632' ' ' HIS . 41.8 mt -56.82 -49.84 74.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.144 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 634' ' ' ARG . . . . . 0.468 ' HG3' ' N ' ' A' ' 635' ' ' SER . 11.8 ptt180 -64.08 -39.34 93.85 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.781 0.324 . . . . 0.0 110.615 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 635' ' ' SER . . . . . 0.468 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 75.1 m -73.61 -17.24 61.19 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.011 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 636' ' ' GLN . . . . . 0.679 ' OE1' HD11 ' A' ' 709' ' ' LEU . 0.0 OUTLIER -93.0 -7.17 46.59 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.466 -179.823 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 111.86 3.69 26.53 Favored Glycine 0 C--N 1.331 0.305 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.601 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 638' ' ' ILE . . . . . 0.452 HG21 ' CZ ' ' A' ' 702' ' ' TYR . 17.3 mt -109.66 104.85 17.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-O 120.694 0.283 . . . . 0.0 111.284 -179.413 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -78.05 129.82 35.7 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.952 0.406 . . . . 0.0 111.061 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 640' ' ' MET . . . . . 0.559 ' HE1' ' HB3' ' A' ' 630' ' ' LYS . 0.2 OUTLIER -129.79 5.59 5.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.466 -179.948 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -58.56 -26.76 63.91 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.742 0.306 . . . . 0.0 111.248 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 642' ' ' GLU . . . . . 0.597 ' O ' HD12 ' A' ' 643' ' ' LEU . 28.9 mt-10 -66.43 -80.8 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.953 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 643' ' ' LEU . . . . . 0.597 HD12 ' O ' ' A' ' 642' ' ' GLU . 0.0 OUTLIER -177.11 118.52 0.26 Allowed Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.901 -179.98 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -65.53 134.49 38.57 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.425 2.083 . . . . 0.0 112.432 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 645' ' ' LEU . . . . . 0.645 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.6 tp -144.06 151.5 39.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.336 0.588 . . . . 0.0 111.441 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 646' ' ' ILE . . . . . 0.557 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.6 tt -149.65 133.49 8.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.228 -0.896 . . . . 0.0 109.705 178.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 52.65 40.73 56.08 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.302 -0.951 . . . . 0.0 112.218 -179.369 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.35 6.78 58.91 Favored Glycine 0 C--N 1.332 0.361 0 C-N-CA 120.986 -0.626 . . . . 0.0 113.839 179.334 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 6.3 m -132.08 163.04 29.34 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 117.413 0.606 . . . . 0.0 111.557 -179.173 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 650' ' ' GLU . . . . . 0.645 ' HA ' HD12 ' A' ' 645' ' ' LEU . 1.0 OUTLIER -78.94 144.27 34.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.727 179.77 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 651' ' ' LEU . . . . . 0.622 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.86 144.99 47.86 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.249 -179.751 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -96.58 110.75 23.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.875 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 653' ' ' LEU . . . . . 0.523 ' HB3' HD13 ' A' ' 629' ' ' ILE . 3.7 mm? -52.14 -32.68 36.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.163 -179.784 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -70.1 -44.41 69.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.166 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 14.4 t -69.1 -37.35 78.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.925 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 656' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -68.77 -45.9 70.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.884 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -58.36 -49.77 76.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.981 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 1.8 mtt85 -60.04 -42.48 94.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.817 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 659' ' ' LEU . . . . . 0.809 HD13 HD21 ' A' ' 682' ' ' LEU . 0.0 OUTLIER -57.67 -50.45 73.14 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.307 -179.729 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 660' ' ' ILE . . . . . 0.663 HD12 HD22 ' A' ' 703' ' ' LEU . 17.3 mt -56.71 -45.57 82.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.782 0.325 . . . . 0.0 110.841 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -63.47 -45.97 88.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.739 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -65.27 -19.97 66.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.2 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 8.9 mmm -90.2 36.67 0.88 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.477 -179.734 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 69.55 40.65 77.96 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.65 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 78.53 174.52 44.23 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.613 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 666' ' ' MET . . . . . 0.582 ' HG2' HG21 ' A' ' 660' ' ' ILE . 0.0 OUTLIER -73.01 -34.66 66.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.803 0.335 . . . . 0.0 111.287 -179.981 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -54.67 -45.7 73.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.434 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 668' ' ' GLN . . . . . 0.482 ' HA ' HD13 ' A' ' 672' ' ' LEU . 0.0 OUTLIER -62.58 -52.37 63.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.955 0.407 . . . . 0.0 110.774 179.943 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 669' ' ' VAL . . . . . 0.514 ' HB ' ' HE2' ' A' ' 666' ' ' MET . 75.1 t -49.21 -55.75 3.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.777 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 670' ' ' THR . . . . . 0.55 HG22 ' O ' ' A' ' 666' ' ' MET . 9.2 t -76.05 -51.65 11.84 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 -178.329 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 671' ' ' ASP . . . . . 0.496 ' N ' HG23 ' A' ' 670' ' ' THR . 4.0 t70 -60.0 -51.2 70.67 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -177.758 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 672' ' ' LEU . . . . . 0.482 HD13 ' HA ' ' A' ' 668' ' ' GLN . 10.7 mp -77.16 1.19 19.03 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -178.862 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 11.6 mtpp 49.36 87.21 0.03 OUTLIER 'General case' 0 CA--C 1.521 -0.163 0 CA-C-O 121.133 0.492 . . . . 0.0 110.385 -179.833 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -150.08 22.07 0.86 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.199 -179.678 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 675' ' ' TRP . . . . . 1.14 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 36.5 m95 -57.83 -28.49 64.13 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 121.444 0.64 . . . . 0.0 109.988 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 676' ' ' ASN . . . . . 0.403 ' O ' ' HB2' ' A' ' 680' ' ' ASP . 5.0 m-80 -55.18 -42.65 73.5 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.608 -179.672 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.78 -51.64 10.19 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.677 0.275 . . . . 0.0 111.662 -179.337 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 1.018 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -56.46 -40.07 74.25 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.827 -0.435 . . . . 0.0 109.827 179.771 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 679' ' ' ALA . . . . . 0.837 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.56 -35.64 70.67 Favored 'General case' 0 C--N 1.334 -0.079 0 CA-C-O 120.763 0.316 . . . . 0.0 110.567 179.199 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 680' ' ' ASP . . . . . 0.403 ' HB2' ' O ' ' A' ' 676' ' ' ASN . 6.0 t0 -53.03 -47.08 68.64 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.382 179.722 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 1.8 mtm -65.4 -22.51 66.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.872 179.448 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 682' ' ' LEU . . . . . 0.809 HD21 HD13 ' A' ' 659' ' ' LEU . 3.5 mm? -78.97 -2.15 38.76 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.576 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 683' ' ' ARG . . . . . 0.732 ' C ' HD12 ' A' ' 684' ' ' ILE . 3.4 mtp180 71.44 72.03 0.17 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.945 0.402 . . . . 0.0 111.608 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 684' ' ' ILE . . . . . 0.732 HD12 ' C ' ' A' ' 683' ' ' ARG . 3.2 mp -131.25 140.1 37.49 Favored Pre-proline 0 CA--C 1.532 0.262 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.282 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 685' ' ' PRO . . . . . 0.61 ' HD2' HG23 ' A' ' 684' ' ' ILE . 32.8 Cg_endo -64.85 123.24 11.35 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.52 2.147 . . . . 0.0 112.756 -179.464 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.97 -23.29 63.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.954 179.637 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.35 -23.73 67.06 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.272 -179.726 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -72.57 111.63 7.91 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.808 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -70.87 -68.83 0.41 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.952 -179.692 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -53.74 -15.71 1.37 Allowed 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -179.443 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 691' ' ' ARG . . . . . 0.433 ' NH2' ' HB3' ' A' ' 679' ' ' ALA . 0.0 OUTLIER -51.91 -35.28 44.94 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.79 0.329 . . . . 0.0 110.867 179.83 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 692' ' ' LEU . . . . . 0.431 HD22 ' N ' ' A' ' 692' ' ' LEU . 3.5 mm? -70.37 -46.85 63.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.938 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.0 -37.85 69.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.236 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 2.9 mmtp -62.61 -39.91 95.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.087 0.47 . . . . 0.0 110.07 179.674 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 1.14 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.4 OUTLIER -66.8 -44.67 80.62 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.44 179.609 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.47 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 3.0 mt-30 -55.22 -46.17 75.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.757 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -77.23 -29.47 54.14 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.878 179.595 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 698' ' ' ALA . . . . . 0.418 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -68.94 -39.5 79.53 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.775 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 699' ' ' TYR . . . . . 0.498 ' CZ ' ' HE1' ' A' ' 666' ' ' MET . 0.7 OUTLIER -85.77 -31.33 22.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.937 0.398 . . . . 0.0 110.562 179.971 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 700' ' ' CYS . . . . . 0.57 ' HA ' HD23 ' A' ' 704' ' ' LEU . 8.6 m -68.14 -30.24 69.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.648 179.601 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.0 -1.25 43.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.411 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 702' ' ' TYR . . . . . 0.452 ' CZ ' HG21 ' A' ' 638' ' ' ILE . 6.1 m-85 -118.69 -78.67 0.59 Allowed 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.871 0.367 . . . . 0.0 111.35 -179.739 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 703' ' ' LEU . . . . . 0.663 HD22 HD12 ' A' ' 660' ' ' ILE . 0.4 OUTLIER -59.24 -42.02 90.11 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.712 -179.243 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.57 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.6 OUTLIER -55.21 -41.61 72.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.874 0.369 . . . . 0.0 111.136 -179.71 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.45 -55.87 28.27 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.408 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 706' ' ' TYR . . . . . 0.483 ' HA ' HD12 ' A' ' 709' ' ' LEU . 3.1 t80 -56.34 -47.75 78.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.984 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -66.54 -18.57 65.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.133 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 24.9 p -91.36 -29.38 17.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.802 0.334 . . . . 0.0 110.904 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 709' ' ' LEU . . . . . 0.679 HD11 ' OE1' ' A' ' 636' ' ' GLN . 74.9 mt -61.32 157.56 16.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.902 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -79.11 165.66 47.32 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.711 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -55.52 -22.36 34.58 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.482 2.121 . . . . 0.0 112.172 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -61.87 -54.31 43.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.903 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 713' ' ' GLU . . . . . 0.585 ' HG3' HD22 ' A' ' 709' ' ' LEU . 52.6 mm-40 -60.45 -26.38 66.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.109 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 16.4 m170 -75.98 -54.42 6.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.479 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 715' ' ' ARG . . . . . 0.457 ' HG3' ' N ' ' A' ' 716' ' ' ARG . 0.8 OUTLIER -62.56 -41.33 98.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.464 -179.451 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 716' ' ' ARG . . . . . 0.457 ' N ' ' HG3' ' A' ' 715' ' ' ARG . 0.2 OUTLIER -66.92 -54.0 26.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.844 0.354 . . . . 0.0 111.061 -179.654 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 717' ' ' LEU . . . . . 0.596 HD13 ' HB3' ' A' ' 632' ' ' HIS . 59.9 mt -63.13 -41.24 99.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.969 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -69.17 -54.3 15.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.552 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.26 -32.35 24.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.167 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 720' ' ' GLU . . . . . 0.446 ' O ' ' HG2' ' A' ' 723' ' ' MET . 1.8 mt-10 -70.17 -55.55 9.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.047 0.451 . . . . 0.0 110.402 179.633 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 721' ' ' VAL . . . . . 0.614 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 20.0 t -62.59 -53.89 41.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.13 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 722' ' ' LEU . . . . . 0.513 HD11 ' HG2' ' A' ' 624' ' ' GLN . 1.1 mp -52.93 -41.3 64.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.046 -179.222 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 723' ' ' MET . . . . . 0.591 ' O ' HD12 ' A' ' 727' ' ' ILE . 15.2 ptp -72.97 -40.09 65.59 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.121 179.745 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -57.54 -31.31 65.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.321 -179.687 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 725' ' ' LYS . . . . . 0.439 ' HD3' ' CE2' ' A' ' 619' ' ' TRP . 3.4 pttp -86.14 -39.83 16.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.402 -179.763 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -69.86 -51.89 29.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.24 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 727' ' ' ILE . . . . . 0.627 ' O ' HG22 ' A' ' 727' ' ' ILE . 3.9 mp -87.7 11.63 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.733 -179.773 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 3.0 tt -56.27 -42.41 77.39 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.82 0.343 . . . . 0.0 111.007 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -75.22 -54.11 7.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.948 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 1.2 mtmm . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.899 179.98 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.232 0 N-CA-C 112.492 -0.243 . . . . 0.0 112.492 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -68.98 -29.68 27.21 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.621 2.214 . . . . 0.0 112.305 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 5.5 mt -66.06 170.55 5.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.909 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 99.61 147.66 21.87 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.512 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 60.99 77.35 0.33 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.862 0.363 . . . . 0.0 110.922 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 3.4 mt -85.44 -178.69 6.77 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.813 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 152.58 110.09 0.43 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.634 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 617' ' ' ARG . . . . . 0.46 ' HG2' ' O ' ' A' ' 617' ' ' ARG . 0.0 OUTLIER -122.25 118.38 28.41 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 121.524 0.678 . . . . 0.0 110.625 179.869 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -103.93 137.24 42.2 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.069 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 619' ' ' TRP . . . . . 0.468 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.0 OUTLIER -74.89 -12.58 60.4 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.345 179.981 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 122.15 159.95 10.79 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.498 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -68.42 -32.68 25.01 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.555 2.17 . . . . 0.0 112.025 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 622' ' ' ASN . . . . . 0.506 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 6.8 p30 -70.74 -33.51 70.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.702 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 623' ' ' VAL . . . . . 0.468 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 57.0 t -76.04 -41.65 38.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.34 179.153 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 624' ' ' GLN . . . . . 0.699 ' CG ' HD11 ' A' ' 722' ' ' LEU . 7.8 tm0? -59.36 -40.45 86.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.253 179.514 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.53 -50.93 63.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.301 179.399 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 626' ' ' LEU . . . . . 0.709 HD13 ' O ' ' A' ' 626' ' ' LEU . 2.8 tm? -57.83 -39.49 77.77 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.653 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 627' ' ' ALA . . . . . 0.455 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -69.09 -52.59 26.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.282 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -56.92 -50.54 72.24 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.235 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 629' ' ' ILE . . . . . 0.599 HG22 HD11 ' A' ' 633' ' ' LEU . 25.6 mt -59.29 -39.53 79.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.153 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 7.0 ttpt -63.8 -49.64 72.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.919 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.32 -40.86 78.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.223 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 632' ' ' HIS . . . . . 0.907 ' CE1' HD11 ' A' ' 709' ' ' LEU . 85.6 t60 -71.67 -40.9 69.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.039 -179.86 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.745 HD13 ' SD ' ' A' ' 640' ' ' MET . 10.2 mt -56.83 -49.9 74.02 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.147 -179.74 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 1.5 ptt180 -65.71 -40.52 92.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.754 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 66.1 m -73.33 -13.74 61.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.25 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -98.06 -4.74 35.32 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 109.24 5.84 30.01 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.558 -0.83 . . . . 0.0 112.536 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 638' ' ' ILE . . . . . . . . . . . . . 18.1 mt -113.77 108.96 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-O 120.648 0.261 . . . . 0.0 111.277 -179.258 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -83.67 107.73 16.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.851 0.358 . . . . 0.0 110.913 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 640' ' ' MET . . . . . 0.745 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.6 ttp -117.09 35.14 4.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.817 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -74.61 -37.75 62.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.157 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -62.02 -82.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.052 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 1.7 pp -177.8 117.43 0.25 Allowed Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.949 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -59.33 150.94 71.55 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.406 2.071 . . . . 0.0 112.241 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 645' ' ' LEU . . . . . 0.692 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.7 tp -144.39 151.4 39.22 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.191 0.52 . . . . 0.0 111.405 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 646' ' ' ILE . . . . . 0.755 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.6 tt -149.81 133.87 8.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.688 178.864 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 52.57 40.12 54.6 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.34 -0.933 . . . . 0.0 112.282 -179.298 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.58 7.42 61.07 Favored Glycine 0 C--N 1.333 0.404 0 C-N-CA 120.964 -0.636 . . . . 0.0 113.658 179.388 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.7 m -131.99 162.35 30.92 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 117.346 0.573 . . . . 0.0 111.481 -179.271 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 650' ' ' GLU . . . . . 0.692 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.9 OUTLIER -77.77 143.84 37.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.825 179.809 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 651' ' ' LEU . . . . . 0.613 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -135.42 145.4 47.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.066 0.46 . . . . 0.0 111.426 -179.588 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -99.18 112.36 24.53 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.754 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 653' ' ' LEU . . . . . 0.403 ' HA ' HD13 ' A' ' 653' ' ' LEU . 3.7 mm? -52.64 -39.06 61.4 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.008 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 654' ' ' ALA . . . . . 0.506 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -64.14 -43.73 94.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.003 179.878 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 4.2 t -67.57 -39.67 84.91 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.043 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 656' ' ' PHE . . . . . 0.439 ' CE2' ' HG ' ' A' ' 682' ' ' LEU . 0.7 OUTLIER -67.44 -42.74 82.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.708 -179.983 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -59.7 -45.9 90.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.805 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 3.8 mtm180 -63.04 -43.21 99.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.538 179.834 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 659' ' ' LEU . . . . . 0.434 HD11 ' CE ' ' A' ' 681' ' ' MET . 0.6 OUTLIER -57.16 -51.45 69.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.966 179.972 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 660' ' ' ILE . . . . . 0.767 HG23 HG21 ' A' ' 669' ' ' VAL . 67.7 mt -57.68 -45.55 86.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.858 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -59.79 -39.69 85.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.82 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -61.15 -21.73 64.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.151 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 663' ' ' MET . . . . . 0.429 ' CE ' ' HB3' ' A' ' 678' ' ' LEU . 0.0 OUTLIER -88.47 14.38 9.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.627 -179.769 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 86.11 17.63 60.73 Favored Glycine 0 C--N 1.332 0.358 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.926 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 111.49 169.87 18.79 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.592 -0.813 . . . . 0.0 112.71 179.853 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 666' ' ' MET . . . . . 0.725 ' HG2' HG21 ' A' ' 660' ' ' ILE . 0.0 OUTLIER -63.83 -31.93 73.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.768 0.318 . . . . 0.0 111.046 -179.972 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -55.6 -48.19 75.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.443 -179.573 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 668' ' ' GLN . . . . . 0.401 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 12.8 mm100 -62.24 -52.59 63.13 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.842 0.354 . . . . 0.0 111.136 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 669' ' ' VAL . . . . . 0.767 HG21 HG23 ' A' ' 660' ' ' ILE . 60.7 t -50.92 -55.89 5.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.944 -179.649 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 670' ' ' THR . . . . . 0.523 HG23 ' N ' ' A' ' 671' ' ' ASP . 10.8 t -76.17 -53.07 8.82 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 -178.297 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 671' ' ' ASP . . . . . 0.523 ' N ' HG23 ' A' ' 670' ' ' THR . 4.4 t70 -57.32 -51.07 70.86 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -177.722 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 672' ' ' LEU . . . . . 0.401 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 9.1 mp -78.7 2.3 20.07 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -178.939 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 3.8 mmtp 48.27 86.09 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.076 0.465 . . . . 0.0 110.517 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -149.15 21.68 0.96 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.147 -179.855 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 675' ' ' TRP . . . . . 1.115 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 31.4 m95 -57.71 -28.4 63.82 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 121.327 0.584 . . . . 0.0 110.145 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -56.07 -42.05 76.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.853 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -77.49 -51.74 10.23 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 120.765 0.316 . . . . 0.0 111.665 -179.261 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 1.036 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -57.27 -40.55 77.96 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.677 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 679' ' ' ALA . . . . . 0.8 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.76 -33.63 68.81 Favored 'General case' 0 C--N 1.334 -0.082 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.412 178.93 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.16 -49.73 66.03 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.319 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 681' ' ' MET . . . . . 0.434 ' CE ' HD11 ' A' ' 659' ' ' LEU . 4.5 mtm -64.06 -22.37 66.9 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.867 179.366 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 682' ' ' LEU . . . . . 0.44 ' HB3' HD11 ' A' ' 684' ' ' ILE . 2.5 mm? -78.41 -3.34 42.77 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.526 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 683' ' ' ARG . . . . . 0.71 ' C ' HD12 ' A' ' 684' ' ' ILE . 23.9 mmt85 70.56 71.92 0.2 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.898 0.38 . . . . 0.0 111.546 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 684' ' ' ILE . . . . . 0.71 HD12 ' C ' ' A' ' 683' ' ' ARG . 2.1 mp -123.0 142.43 38.14 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.158 179.436 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 685' ' ' PRO . . . . . 0.698 ' HD2' HG23 ' A' ' 684' ' ' ILE . 53.5 Cg_endo -69.86 119.12 6.12 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.499 2.133 . . . . 0.0 112.634 -179.674 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.96 -23.04 63.12 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.045 179.658 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.23 -22.5 66.88 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.463 -179.635 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 688' ' ' ALA . . . . . 0.759 ' HB3' ' HG2' ' A' ' 691' ' ' ARG . . . -71.84 117.23 13.18 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.928 0.394 . . . . 0.0 111.075 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.25 3.82 29.61 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.37 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -121.69 -13.89 8.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.155 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 691' ' ' ARG . . . . . 0.826 ' HG3' HD22 ' A' ' 692' ' ' LEU . 0.2 OUTLIER -55.0 -35.1 64.0 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.811 0.338 . . . . 0.0 110.933 -179.673 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 692' ' ' LEU . . . . . 0.826 HD22 ' HG3' ' A' ' 691' ' ' ARG . 3.0 mm? -70.6 -47.69 58.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.042 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.93 -39.58 69.36 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.415 -179.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 3.8 mmtt -64.24 -40.78 96.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.241 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 1.115 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 3.9 tp -63.89 -47.04 82.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.844 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.431 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 0.0 OUTLIER -55.27 -49.09 72.96 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.189 -179.743 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -75.19 -29.49 60.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.126 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -68.54 -38.09 80.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.749 -179.587 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 699' ' ' TYR . . . . . 0.458 ' CD2' ' CZ2' ' A' ' 675' ' ' TRP . 1.0 OUTLIER -86.47 -30.52 21.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.831 0.348 . . . . 0.0 110.736 -179.877 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 700' ' ' CYS . . . . . . . . . . . . . 15.3 t -69.45 -30.51 68.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.644 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -97.46 -1.37 44.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.472 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 702' ' ' TYR . . . . . 0.593 ' CD2' HD21 ' A' ' 633' ' ' LEU . 7.1 m-85 -121.51 -78.64 0.6 Allowed 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.831 0.348 . . . . 0.0 111.316 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 703' ' ' LEU . . . . . 0.622 ' CD2' HD12 ' A' ' 660' ' ' ILE . 1.1 mp -57.63 -44.55 85.66 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.523 -179.444 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.431 HD23 ' CE1' ' A' ' 699' ' ' TYR . 1.1 mm? -56.4 -49.41 74.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.86 0.362 . . . . 0.0 110.959 -179.801 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 705' ' ' SER . . . . . 0.402 ' O ' ' HG ' ' A' ' 709' ' ' LEU . 22.7 m -54.7 -55.29 31.31 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.719 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 706' ' ' TYR . . . . . 0.599 ' HA ' HD12 ' A' ' 709' ' ' LEU . 56.4 t80 -63.77 -29.35 70.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.202 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -79.0 -20.96 47.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.247 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 1.7 m -91.54 -17.59 25.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.283 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 709' ' ' LEU . . . . . 0.907 HD11 ' CE1' ' A' ' 632' ' ' HIS . 78.2 mt -58.62 153.12 17.01 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.914 0.387 . . . . 0.0 111.113 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 710' ' ' SER . . . . . 0.451 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.6 OUTLIER -79.06 168.46 26.78 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.473 179.619 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 711' ' ' PRO . . . . . 0.451 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 14.4 Cg_endo -56.8 -19.78 32.72 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.518 2.145 . . . . 0.0 112.524 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -67.49 -55.55 13.13 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.038 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 713' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -59.34 -26.17 64.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.075 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -75.83 -54.1 7.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.256 179.419 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 7.0 mtm180 -63.44 -40.82 98.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.428 -179.594 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.54 -54.08 27.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.755 0.312 . . . . 0.0 111.241 -179.598 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 717' ' ' LEU . . . . . 0.635 HD13 ' HB2' ' A' ' 632' ' ' HIS . 57.8 mt -64.85 -39.39 93.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.975 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 718' ' ' GLU . . . . . 0.65 ' HG2' HD22 ' A' ' 722' ' ' LEU . 13.7 tt0 -69.29 -54.2 15.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.561 179.828 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 9.4 mmtt -52.89 -33.33 49.75 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.378 -179.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 720' ' ' GLU . . . . . 0.433 ' O ' ' HG2' ' A' ' 723' ' ' MET . 12.3 mt-10 -69.56 -55.76 9.23 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.079 0.466 . . . . 0.0 110.623 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 721' ' ' VAL . . . . . 0.455 HG11 ' HB1' ' A' ' 627' ' ' ALA . 45.8 t -63.76 -53.33 45.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.15 -179.636 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 722' ' ' LEU . . . . . 0.699 HD11 ' CG ' ' A' ' 624' ' ' GLN . 8.0 mp -54.4 -38.77 66.59 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.865 -179.173 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 723' ' ' MET . . . . . 0.499 ' HB2' HD13 ' A' ' 727' ' ' ILE . 13.6 ptp -75.38 -40.61 57.82 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.033 179.605 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -54.32 -40.02 67.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.178 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 725' ' ' LYS . . . . . 0.454 ' HE2' ' CD2' ' A' ' 619' ' ' TRP . 0.0 OUTLIER -85.45 -42.64 14.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.097 -179.86 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -59.51 -53.46 57.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.949 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 727' ' ' ILE . . . . . 0.643 ' O ' HG22 ' A' ' 727' ' ' ILE . 4.2 mp -89.37 11.7 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.551 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 728' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 725' ' ' LYS . 1.7 tt -57.34 -45.56 84.2 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.853 0.359 . . . . 0.0 111.049 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -73.86 -54.71 7.37 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.979 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 6.9 mtmm . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.981 179.998 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.238 0 N-CA-C 112.504 -0.238 . . . . 0.0 112.504 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -68.01 -36.45 17.5 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.541 2.16 . . . . 0.0 112.346 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 3.3 mp -69.2 158.07 35.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.867 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . -76.32 76.97 1.42 Allowed Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.489 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -143.01 97.39 3.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.858 0.361 . . . . 0.0 110.866 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 11.8 mt -95.85 -176.27 3.67 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.924 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -114.22 58.54 0.43 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.536 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 34.7 mmt-85 -139.42 120.17 14.3 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 121.139 0.495 . . . . 0.0 110.657 179.783 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -176.18 134.77 0.26 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.83 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 619' ' ' TRP . . . . . 0.442 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.0 OUTLIER -62.29 -17.11 57.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.284 -179.97 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 126.11 163.21 11.49 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.491 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -68.52 -37.59 12.66 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.582 2.188 . . . . 0.0 112.241 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -67.35 -38.86 85.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.915 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 623' ' ' VAL . . . . . 0.442 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 40.1 t -70.98 -41.92 76.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.967 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 624' ' ' GLN . . . . . 0.499 ' CG ' HD21 ' A' ' 722' ' ' LEU . 1.2 tm0? -58.6 -45.53 88.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.712 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 74.5 mtt-85 -62.18 -50.63 71.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.708 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 626' ' ' LEU . . . . . 0.599 HD23 ' O ' ' A' ' 626' ' ' LEU . 8.6 tt -61.51 -34.09 74.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.819 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 627' ' ' ALA . . . . . 0.661 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -63.98 -53.76 45.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.185 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -58.97 -42.56 90.25 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.997 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 629' ' ' ILE . . . . . 0.453 HG23 ' HE1' ' A' ' 632' ' ' HIS . 38.3 mt -60.32 -51.39 73.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.048 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 4.7 ttpp -60.79 -32.82 72.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.249 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.67 -48.08 76.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.614 -179.507 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 632' ' ' HIS . . . . . 0.58 ' HB3' HD13 ' A' ' 717' ' ' LEU . 3.3 p-80 -69.47 -39.84 77.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.921 -179.747 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.512 HD13 ' SD ' ' A' ' 640' ' ' MET . 20.4 mt -55.86 -48.25 75.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.203 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 634' ' ' ARG . . . . . 0.433 ' HG3' ' N ' ' A' ' 635' ' ' SER . 0.1 OUTLIER -67.01 -39.92 87.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.719 0.295 . . . . 0.0 110.814 179.892 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 635' ' ' SER . . . . . 0.433 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 8.5 m -73.75 -14.03 61.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.42 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 636' ' ' GLN . . . . . 0.414 ' HB2' ' O ' ' A' ' 632' ' ' HIS . 0.0 OUTLIER -97.39 -8.26 29.91 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 -179.675 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 118.83 -8.46 12.86 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.583 179.696 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 638' ' ' ILE . . . . . 0.648 ' N ' HD12 ' A' ' 638' ' ' ILE . 3.5 mp -99.5 104.65 16.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.744 0.307 . . . . 0.0 111.03 -179.636 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 3.2 m -80.57 114.12 19.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.885 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 640' ' ' MET . . . . . 0.512 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.8 ttp -122.6 27.85 7.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.932 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.46 -52.8 59.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.888 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 642' ' ' GLU . . . . . 0.588 ' O ' HD12 ' A' ' 643' ' ' LEU . 0.6 OUTLIER -50.55 -72.39 0.05 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.23 -179.901 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 643' ' ' LEU . . . . . 0.588 HD12 ' O ' ' A' ' 642' ' ' GLU . 0.2 OUTLIER 179.67 134.4 0.25 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.81 179.843 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.13 122.96 7.47 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.455 2.103 . . . . 0.0 112.343 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 645' ' ' LEU . . . . . 0.612 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.9 tp -125.73 153.39 44.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.305 0.574 . . . . 0.0 111.319 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 646' ' ' ILE . . . . . 0.554 HD11 ' HA ' ' A' ' 695' ' ' LEU . 2.2 tt -149.62 133.17 7.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.448 179.156 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 50.59 43.61 45.97 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.246 -0.978 . . . . 0.0 112.138 -179.297 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 68.58 6.19 48.31 Favored Glycine 0 CA--C 1.52 0.378 0 C-N-CA 121.127 -0.559 . . . . 0.0 113.991 179.304 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 4.0 m -131.27 162.79 29.24 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 117.68 0.74 . . . . 0.0 111.696 -178.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 650' ' ' GLU . . . . . 0.612 ' HA ' HD12 ' A' ' 645' ' ' LEU . 2.5 mp0 -81.25 142.42 33.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.743 179.752 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 651' ' ' LEU . . . . . 0.644 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.11 144.76 48.78 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.071 0.462 . . . . 0.0 111.099 179.891 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.88 109.43 21.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.926 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -52.21 -42.62 63.69 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.083 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -62.78 -46.34 88.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.272 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 40.4 t -67.69 -37.58 82.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.911 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 656' ' ' PHE . . . . . 0.464 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.2 OUTLIER -68.82 -44.39 73.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.981 -179.898 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -59.96 -46.35 89.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.004 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.14 -43.89 98.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.009 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 659' ' ' LEU . . . . . 0.546 HD13 HD21 ' A' ' 682' ' ' LEU . 0.1 OUTLIER -56.7 -45.1 82.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.401 -179.65 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 660' ' ' ILE . . . . . 0.742 HG23 HG21 ' A' ' 669' ' ' VAL . 37.2 mt -62.97 -44.47 99.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.264 -179.845 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -64.3 -45.2 89.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.641 -179.427 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 662' ' ' GLU . . . . . 0.441 ' HG2' ' HA ' ' A' ' 659' ' ' LEU . 18.3 pt-20 -66.36 -14.15 61.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.598 -179.585 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.67 34.7 1.45 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.803 0.335 . . . . 0.0 111.199 -179.784 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 73.89 32.86 58.41 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.827 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 85.54 172.59 49.07 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.606 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 666' ' ' MET . . . . . 0.679 ' O ' HG22 ' A' ' 670' ' ' THR . 10.1 tpt -72.15 -28.87 63.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.643 0.259 . . . . 0.0 111.237 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -55.07 -48.29 73.72 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.106 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 668' ' ' GLN . . . . . 0.4 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -63.0 -51.86 65.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.856 0.36 . . . . 0.0 110.812 179.949 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 669' ' ' VAL . . . . . 0.742 HG21 HG23 ' A' ' 660' ' ' ILE . 40.7 t -49.19 -55.31 4.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.722 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 670' ' ' THR . . . . . 0.679 HG22 ' O ' ' A' ' 666' ' ' MET . 9.7 t -76.02 -50.69 14.12 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -178.372 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 671' ' ' ASP . . . . . 0.471 ' N ' HG23 ' A' ' 670' ' ' THR . 40.0 m-20 -62.14 -51.27 68.55 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -177.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 672' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 4.4 mm? -78.0 3.55 14.47 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -179.16 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 1.7 mttt 49.07 86.43 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.996 0.427 . . . . 0.0 110.477 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 27.7 mttt -144.88 22.21 1.59 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.229 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 675' ' ' TRP . . . . . 1.116 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 36.6 m95 -61.21 -30.34 70.37 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 121.409 0.624 . . . . 0.0 110.173 179.873 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -57.02 -43.29 81.69 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.372 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.18 -51.52 11.96 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.802 0.334 . . . . 0.0 111.243 -179.615 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.973 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.84 -40.29 72.62 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.572 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 679' ' ' ALA . . . . . 0.835 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.6 -33.68 69.23 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.551 179.107 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -53.77 -49.51 68.09 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.363 179.641 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 5.4 mtp -62.73 -22.21 66.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.763 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 682' ' ' LEU . . . . . 0.546 HD21 HD13 ' A' ' 659' ' ' LEU . 3.2 mm? -79.28 -1.13 35.22 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.457 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 683' ' ' ARG . . . . . 0.776 ' C ' HD12 ' A' ' 684' ' ' ILE . 0.0 OUTLIER 70.63 71.93 0.2 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.956 0.408 . . . . 0.0 111.343 179.98 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 684' ' ' ILE . . . . . 0.776 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.8 mp -124.43 136.99 28.45 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.682 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 685' ' ' PRO . . . . . 0.431 ' HD2' HG23 ' A' ' 684' ' ' ILE . 36.8 Cg_endo -65.99 125.2 13.75 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.474 2.116 . . . . 0.0 112.361 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.85 -13.94 62.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.393 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.3 -23.18 66.95 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.734 0.302 . . . . 0.0 111.207 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 688' ' ' ALA . . . . . 0.422 ' HB1' ' HG3' ' A' ' 691' ' ' ARG . . . -82.81 107.6 15.55 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.949 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -75.09 -68.33 0.56 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.206 -179.767 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 70.8 m-20 -54.6 -17.36 3.21 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.811 -179.696 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 691' ' ' ARG . . . . . 0.425 ' NH1' HG13 ' A' ' 684' ' ' ILE . 0.0 OUTLIER -45.93 -40.51 10.31 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.876 0.369 . . . . 0.0 111.299 179.859 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -59.69 -42.06 92.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.056 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.23 -37.23 69.21 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.892 0.377 . . . . 0.0 111.159 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -65.11 -42.96 93.47 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.29 179.544 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 1.116 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.4 OUTLIER -63.98 -43.91 94.31 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.422 179.67 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.445 ' O ' ' CD1' ' A' ' 699' ' ' TYR . 5.1 tp60 -56.17 -44.82 79.71 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.643 179.76 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -77.22 -29.8 54.32 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.176 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 698' ' ' ALA . . . . . 0.445 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.39 -37.53 83.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.729 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 699' ' ' TYR . . . . . 0.541 ' CZ ' ' HE2' ' A' ' 666' ' ' MET . 2.1 p90 -84.92 -37.62 20.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.969 0.414 . . . . 0.0 110.232 179.646 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 700' ' ' CYS . . . . . 0.642 ' HA ' HD23 ' A' ' 704' ' ' LEU . 15.3 t -60.88 -30.32 70.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.646 179.656 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -100.09 -0.42 39.06 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.453 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 702' ' ' TYR . . . . . 0.452 ' CZ ' HG21 ' A' ' 638' ' ' ILE . 5.1 m-85 -117.69 -79.05 0.59 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.78 0.324 . . . . 0.0 111.623 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 5.9 mp -64.41 -40.35 95.61 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.951 -179.039 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.642 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.4 OUTLIER -47.44 -56.63 6.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.806 0.336 . . . . 0.0 111.515 -179.593 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.28 -46.12 72.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.251 -179.547 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 706' ' ' TYR . . . . . 0.573 ' O ' HD22 ' A' ' 709' ' ' LEU . 10.2 t80 -61.95 -29.47 70.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.135 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -95.45 -4.46 45.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.497 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 8.6 p -112.52 -23.19 10.41 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.613 0.244 . . . . 0.0 111.378 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 709' ' ' LEU . . . . . 0.642 HD21 ' CD2' ' A' ' 714' ' ' HIS . 0.2 OUTLIER -70.15 172.61 7.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.812 0.339 . . . . 0.0 110.938 -179.942 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.6 165.57 51.86 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.098 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -68.42 -22.69 38.8 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.633 2.222 . . . . 0.0 112.191 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -52.3 -51.09 60.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.853 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 713' ' ' GLU . . . . . 0.552 ' HB2' HD11 ' A' ' 709' ' ' LEU . 1.6 mm-40 -57.96 -27.13 63.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.149 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 714' ' ' HIS . . . . . 0.642 ' CD2' HD21 ' A' ' 709' ' ' LEU . 24.8 m-70 -76.03 -53.8 7.81 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.669 179.61 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.53 -46.61 88.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.56 -179.44 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 716' ' ' ARG . . . . . 0.4 ' CG ' ' N ' ' A' ' 717' ' ' LEU . 4.7 ptt180 -67.54 -51.57 49.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.797 -179.188 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 717' ' ' LEU . . . . . 0.58 HD13 ' HB3' ' A' ' 632' ' ' HIS . 90.8 mt -64.57 -43.61 93.32 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.693 0.282 . . . . 0.0 111.072 -179.57 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 718' ' ' GLU . . . . . 0.62 ' HG3' HD23 ' A' ' 722' ' ' LEU . 10.8 tt0 -65.75 -54.17 30.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.242 179.723 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -50.46 -35.62 29.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.373 -179.834 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 720' ' ' GLU . . . . . 0.436 ' O ' ' HG2' ' A' ' 723' ' ' MET . 9.9 mt-10 -70.8 -55.47 8.49 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.933 0.397 . . . . 0.0 110.992 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 721' ' ' VAL . . . . . 0.661 HG11 ' HB1' ' A' ' 627' ' ' ALA . 22.0 t -63.63 -55.17 24.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.168 -179.487 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 722' ' ' LEU . . . . . 0.62 HD23 ' HG3' ' A' ' 718' ' ' GLU . 3.7 mm? -53.38 -42.37 66.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.999 -179.272 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 723' ' ' MET . . . . . 0.579 ' O ' HD12 ' A' ' 727' ' ' ILE . 14.1 ptp -68.66 -38.82 80.71 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 120.38 -0.528 . . . . 0.0 109.98 179.563 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -57.77 -35.02 70.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.157 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 725' ' ' LYS . . . . . 0.436 ' HD2' ' CE2' ' A' ' 619' ' ' TRP . 0.7 OUTLIER -86.11 -34.69 20.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.497 -179.654 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 726' ' ' GLU . . . . . 0.416 ' N ' ' HG3' ' A' ' 725' ' ' LYS . 10.3 mt-10 -72.37 -51.67 19.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.901 0.381 . . . . 0.0 111.189 -179.64 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 727' ' ' ILE . . . . . 0.632 ' O ' HG22 ' A' ' 727' ' ' ILE . 4.2 mp -87.55 11.68 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.647 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 8.5 tp -55.23 -56.22 22.43 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.775 0.322 . . . . 0.0 111.261 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -56.92 -49.05 76.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.266 -179.603 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.324 -0.846 . . . . 0.0 110.905 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 112.533 -0.227 . . . . 0.0 112.533 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -70.03 -28.11 24.34 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.651 2.234 . . . . 0.0 112.285 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.13 163.14 13.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.883 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 89.04 107.71 1.11 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.461 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 2.8 m -147.88 101.88 3.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.894 0.378 . . . . 0.0 110.94 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 70.8 mt -108.94 -176.96 3.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.891 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -134.59 -79.84 0.13 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.555 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -121.47 -143.09 0.34 Allowed 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 110.572 -0.159 . . . . 0.0 110.572 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.3 149.06 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.91 0.386 . . . . 0.0 110.969 -179.861 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 619' ' ' TRP . . . . . 0.607 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.1 OUTLIER -98.82 -15.33 19.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.464 -179.831 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 118.22 166.45 13.74 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.49 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.31 -39.84 5.05 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.501 2.134 . . . . 0.0 112.363 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 622' ' ' ASN . . . . . 0.459 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 29.5 m-80 -63.78 -36.87 85.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.952 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 623' ' ' VAL . . . . . 0.46 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 48.6 t -68.64 -45.56 81.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.884 179.737 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 624' ' ' GLN . . . . . 0.561 ' HG2' HD21 ' A' ' 722' ' ' LEU . 27.7 tp60 -59.65 -36.92 77.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.527 179.713 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 625' ' ' ARG . . . . . 0.433 ' HD3' ' CE2' ' A' ' 657' ' ' PHE . 0.1 OUTLIER -63.36 -50.79 68.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.509 179.694 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 6.3 tt -67.16 -27.5 67.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.921 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -73.47 -42.97 61.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.287 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.02 -34.92 73.9 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.176 -179.802 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 19.5 mt -68.94 -49.11 66.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.323 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.86 -35.8 81.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.932 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 631' ' ' LYS . . . . . 0.41 ' O ' ' HG2' ' A' ' 634' ' ' ARG . 0.1 OUTLIER -64.52 -44.08 92.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.993 0.425 . . . . 0.0 110.702 179.775 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 632' ' ' HIS . . . . . 0.458 ' CG ' HD11 ' A' ' 709' ' ' LEU . 35.7 t60 -69.64 -41.63 75.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.806 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.414 ' CD2' ' CD2' ' A' ' 702' ' ' TYR . 42.6 mt -57.14 -49.93 74.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.145 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 634' ' ' ARG . . . . . 0.41 ' HG2' ' O ' ' A' ' 631' ' ' LYS . 0.0 OUTLIER -62.32 -43.5 98.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.709 179.793 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.58 -14.1 61.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.33 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 37.2 tp60 -96.5 -8.18 32.76 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 111.649 0.241 . . . . 0.0 111.649 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 115.13 0.43 22.46 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.52 179.784 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 638' ' ' ILE . . . . . 0.566 HG21 ' CZ ' ' A' ' 702' ' ' TYR . 14.7 mt -109.41 104.93 17.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 120.766 0.317 . . . . 0.0 111.192 -179.494 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 1.3 m -83.28 104.14 13.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.048 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 640' ' ' MET . . . . . 0.405 ' HE2' HD12 ' A' ' 633' ' ' LEU . 0.0 OUTLIER -98.28 25.96 5.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.818 179.854 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -78.06 -33.11 51.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.812 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -59.49 -73.4 0.09 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.84 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 179.13 118.41 0.21 Allowed Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.877 179.822 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.76 127.75 16.76 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.364 2.042 . . . . 0.0 111.967 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 645' ' ' LEU . . . . . 0.629 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.3 tp -142.68 152.54 42.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.407 0.623 . . . . 0.0 111.836 -179.857 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 646' ' ' ILE . . . . . 0.517 HD11 ' HA ' ' A' ' 695' ' ' LEU . 3.0 tt -149.86 133.53 8.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.552 178.772 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 51.59 41.75 50.25 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.223 -0.989 . . . . 0.0 112.222 -179.359 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.22 5.61 54.58 Favored Glycine 0 CA--C 1.521 0.466 0 C-N-CA 121.065 -0.588 . . . . 0.0 113.971 179.31 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.8 m -130.89 162.36 29.83 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 117.561 0.681 . . . . 0.0 111.66 -179.084 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 650' ' ' GLU . . . . . 0.629 ' HA ' HD12 ' A' ' 645' ' ' LEU . 1.6 mp0 -79.2 144.21 34.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.787 179.763 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 651' ' ' LEU . . . . . 0.635 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -135.25 144.98 47.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.098 0.475 . . . . 0.0 111.433 -179.737 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.71 111.15 23.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.821 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -52.23 -43.41 64.27 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.146 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 654' ' ' ALA . . . . . 0.459 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -59.25 -45.6 90.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.206 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 37.2 t -68.9 -33.9 74.53 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.756 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 656' ' ' PHE . . . . . 0.456 ' CE1' ' HB2' ' A' ' 651' ' ' LEU . 0.8 OUTLIER -68.54 -46.2 70.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.006 179.966 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 657' ' ' PHE . . . . . 0.433 ' CE2' ' HD3' ' A' ' 625' ' ' ARG . 75.7 t80 -60.82 -48.55 81.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.137 -179.816 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.13 -45.52 87.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.262 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 659' ' ' LEU . . . . . 0.847 HD13 ' CD2' ' A' ' 682' ' ' LEU . 0.1 OUTLIER -57.44 -51.0 71.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.547 -179.498 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 660' ' ' ILE . . . . . 0.734 HG23 HG21 ' A' ' 669' ' ' VAL . 53.3 mt -56.75 -44.54 81.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.751 0.31 . . . . 0.0 110.831 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -62.6 -45.13 94.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.786 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -64.48 -14.99 59.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.355 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 1.7 mmm -94.21 28.06 2.64 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.704 0.288 . . . . 0.0 111.214 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 76.03 33.94 48.68 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.641 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 87.23 171.91 47.71 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.535 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 666' ' ' MET . . . . . 0.575 ' O ' HG22 ' A' ' 670' ' ' THR . 10.7 tpt -70.73 -26.48 63.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.699 0.285 . . . . 0.0 111.218 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 667' ' ' GLN . . . . . 0.417 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 20.0 pt20 -58.3 -46.49 86.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.067 -179.79 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 668' ' ' GLN . . . . . 0.588 ' HA ' HD13 ' A' ' 672' ' ' LEU . 12.1 mm100 -64.9 -52.75 54.77 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.901 0.382 . . . . 0.0 110.971 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 669' ' ' VAL . . . . . 0.734 HG21 HG23 ' A' ' 660' ' ' ILE . 47.5 t -49.13 -55.89 3.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.816 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 670' ' ' THR . . . . . 0.575 HG22 ' O ' ' A' ' 666' ' ' MET . 12.6 t -76.23 -47.3 24.44 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -178.394 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 671' ' ' ASP . . . . . 0.44 ' N ' HG23 ' A' ' 670' ' ' THR . 15.4 t0 -66.54 -51.14 59.76 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -177.865 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 672' ' ' LEU . . . . . 0.588 HD13 ' HA ' ' A' ' 668' ' ' GLN . 7.9 mp -76.08 1.93 14.24 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -179.08 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 6.1 tttp 49.87 84.2 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.024 0.44 . . . . 0.0 110.614 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.02 21.63 1.41 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.026 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 675' ' ' TRP . . . . . 1.112 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 31.1 m95 -59.16 -31.7 69.22 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.324 0.583 . . . . 0.0 110.219 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -54.56 -42.97 71.61 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.785 -179.509 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.97 -51.49 11.05 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 120.706 0.289 . . . . 0.0 111.565 -179.327 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 1.008 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.72 -42.52 75.41 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.813 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 679' ' ' ALA . . . . . 0.75 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.64 -33.15 68.68 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 120.84 0.352 . . . . 0.0 110.589 179.037 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.23 -49.32 67.05 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.532 179.601 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 7.0 mtm -64.08 -21.12 66.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.856 179.577 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 682' ' ' LEU . . . . . 0.847 ' CD2' HD13 ' A' ' 659' ' ' LEU . 2.9 mm? -78.96 -1.7 36.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.399 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 683' ' ' ARG . . . . . 0.809 ' C ' HD12 ' A' ' 684' ' ' ILE . 13.5 mmm180 73.17 71.7 0.13 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 121.0 0.428 . . . . 0.0 111.39 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 684' ' ' ILE . . . . . 0.809 HD12 ' C ' ' A' ' 683' ' ' ARG . 2.7 mp -131.72 140.35 38.01 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.135 179.557 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 685' ' ' PRO . . . . . 0.634 ' HD2' HG23 ' A' ' 684' ' ' ILE . 34.7 Cg_endo -65.1 123.09 11.06 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.518 2.145 . . . . 0.0 112.68 -179.611 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.79 -26.2 64.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.96 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 3.1 p -65.36 -21.6 66.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.095 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -71.8 111.08 6.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.871 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 25.7 mm-40 -71.67 -68.92 0.42 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.093 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -52.94 -19.21 2.42 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.909 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 691' ' ' ARG . . . . . 0.502 ' HD2' HG22 ' A' ' 684' ' ' ILE . 0.0 OUTLIER -53.4 -34.69 58.68 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.75 0.31 . . . . 0.0 110.726 179.753 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -70.33 -52.94 19.01 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.175 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -69.36 -36.48 76.9 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.357 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 2.0 tmmm? -63.81 -41.28 97.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.135 0.493 . . . . 0.0 110.003 179.487 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 1.112 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.7 OUTLIER -63.37 -44.92 93.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.421 179.533 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.42 ' O ' ' CD1' ' A' ' 699' ' ' TYR . 43.2 mt-30 -55.53 -44.82 77.06 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.744 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -77.34 -29.78 53.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.206 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 698' ' ' ALA . . . . . 0.409 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.12 -39.05 86.57 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.62 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 699' ' ' TYR . . . . . 0.492 ' CE2' ' HE2' ' A' ' 666' ' ' MET . 1.7 p90 -83.77 -37.49 22.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.017 0.437 . . . . 0.0 110.244 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 700' ' ' CYS . . . . . 0.503 ' HA ' HD23 ' A' ' 704' ' ' LEU . 1.3 m -59.95 -31.71 70.12 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.485 179.708 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.53 -11.06 32.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.223 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 702' ' ' TYR . . . . . 0.566 ' CZ ' HG21 ' A' ' 638' ' ' ILE . 4.0 m-85 -114.44 -76.56 0.58 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.9 0.381 . . . . 0.0 111.405 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -54.66 -49.85 69.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.733 -179.361 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.503 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.5 OUTLIER -49.61 -45.45 48.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.851 0.357 . . . . 0.0 111.353 -179.607 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 2.3 m -55.38 -55.27 33.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.731 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 706' ' ' TYR . . . . . 0.478 ' HA ' HD12 ' A' ' 709' ' ' LEU . 71.5 t80 -64.59 -30.42 71.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.018 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -78.6 -18.62 54.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.423 -179.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 1.7 t -93.13 -19.89 21.04 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.785 0.326 . . . . 0.0 110.97 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 709' ' ' LEU . . . . . 0.741 HD22 ' CB ' ' A' ' 713' ' ' GLU . 49.6 mt -51.48 141.51 15.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.555 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 710' ' ' SER . . . . . 0.439 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.5 OUTLIER -78.03 167.97 31.39 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.5 179.586 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 711' ' ' PRO . . . . . 0.439 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 9.2 Cg_endo -52.58 -22.91 18.05 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.517 2.145 . . . . 0.0 112.374 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -75.98 -55.89 5.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.982 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 713' ' ' GLU . . . . . 0.741 ' CB ' HD22 ' A' ' 709' ' ' LEU . 2.3 mm-40 -58.54 -27.26 64.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.021 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 8.7 m-70 -75.85 -53.96 7.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.432 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.05 -36.48 83.72 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.148 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.43 -54.36 21.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.827 0.346 . . . . 0.0 111.089 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 717' ' ' LEU . . . . . 0.414 ' O ' HG23 ' A' ' 721' ' ' VAL . 83.6 mt -64.42 -40.62 96.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.712 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 718' ' ' GLU . . . . . 0.557 ' HG3' HD23 ' A' ' 722' ' ' LEU . 24.4 tt0 -67.33 -54.03 24.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.398 179.631 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt -50.72 -35.01 29.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.315 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 720' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' A' ' 723' ' ' MET . 10.4 mt-10 -67.77 -55.61 12.4 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.993 0.425 . . . . 0.0 110.544 179.748 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 721' ' ' VAL . . . . . 0.607 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 33.2 t -63.75 -54.73 28.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.106 -179.691 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 722' ' ' LEU . . . . . 0.764 HD13 ' HE2' ' A' ' 725' ' ' LYS . 0.8 OUTLIER -49.06 -44.03 41.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.874 -179.31 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 723' ' ' MET . . . . . 0.537 ' HB2' HD13 ' A' ' 727' ' ' ILE . 16.9 ptp -72.77 -39.9 66.4 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.15 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -50.86 -41.83 58.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.64 -179.305 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 725' ' ' LYS . . . . . 0.764 ' HE2' HD13 ' A' ' 722' ' ' LEU . 0.0 OUTLIER -86.08 -36.82 19.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.686 0.279 . . . . 0.0 111.315 -179.751 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -62.48 -53.61 52.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.989 0.423 . . . . 0.0 110.945 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 727' ' ' ILE . . . . . 0.655 ' O ' HG22 ' A' ' 727' ' ' ILE . 4.6 mp -88.49 11.57 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.552 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 8.7 tt -56.79 -34.17 67.38 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.774 0.321 . . . . 0.0 110.995 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -90.53 -48.32 7.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.938 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 22.6 mtmt . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.852 -179.966 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.227 0 N-CA-C 112.471 -0.252 . . . . 0.0 112.471 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.73 -30.02 15.02 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.579 2.186 . . . . 0.0 112.347 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 2.7 mt -63.39 171.22 2.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.857 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 116.43 48.37 0.47 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.409 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 13.2 m -117.46 31.13 6.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.804 0.335 . . . . 0.0 110.909 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 3.2 mt -92.34 166.37 12.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.837 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -174.11 60.61 0.13 Allowed Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.476 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -83.98 -1.8 55.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.202 0.525 . . . . 0.0 111.505 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.92 139.99 43.7 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.858 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 619' ' ' TRP . . . . . 0.553 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.1 OUTLIER -57.49 -20.93 34.31 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.297 -179.975 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 123.55 164.96 12.17 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.329 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -65.64 -40.8 16.56 Favored 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 122.453 2.102 . . . . 0.0 112.191 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -59.85 -43.25 94.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.918 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 623' ' ' VAL . . . . . 0.452 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 38.3 t -71.54 -38.05 66.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.913 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 624' ' ' GLN . . . . . 0.669 ' CG ' HD11 ' A' ' 722' ' ' LEU . 1.0 OUTLIER -54.3 -45.39 72.54 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.661 179.787 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 8.3 mtt180 -70.68 -39.77 73.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.343 179.423 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 626' ' ' LEU . . . . . 0.8 HD13 ' O ' ' A' ' 626' ' ' LEU . 3.1 tm? -63.28 -32.27 73.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.768 179.663 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 627' ' ' ALA . . . . . 0.496 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -72.9 -48.26 38.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.319 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -57.03 -46.56 82.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.951 -179.783 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 629' ' ' ILE . . . . . 0.428 HG22 ' CD1' ' A' ' 633' ' ' LEU . 10.4 mt -66.38 -38.95 82.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.929 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 15.5 ttpt -64.22 -39.52 94.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.935 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.13 -42.41 89.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.817 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 632' ' ' HIS . . . . . 0.866 ' CE1' HD11 ' A' ' 709' ' ' LEU . 84.1 t60 -70.52 -41.44 72.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.796 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.428 ' CD1' HG22 ' A' ' 629' ' ' ILE . 49.7 mt -58.27 -49.73 76.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.291 -179.718 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 634' ' ' ARG . . . . . 0.442 ' HG3' ' N ' ' A' ' 635' ' ' SER . 3.8 ptt180 -65.79 -38.77 89.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.983 -179.853 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 635' ' ' SER . . . . . 0.442 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 0.3 OUTLIER -73.71 -20.38 60.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.091 179.77 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 636' ' ' GLN . . . . . 0.423 ' CG ' ' CE1' ' A' ' 632' ' ' HIS . 32.4 mm-40 -88.93 -5.25 58.11 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.665 -179.661 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 109.97 -0.85 30.09 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.418 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 638' ' ' ILE . . . . . 0.511 HG21 ' CE2' ' A' ' 702' ' ' TYR . 13.9 mt -103.21 104.62 16.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 CA-C-O 120.703 0.287 . . . . 0.0 111.127 -179.612 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.11 108.43 17.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.899 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 1.6 mtp -119.87 28.6 8.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.864 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -60.99 -33.0 72.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.835 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -67.48 -78.62 0.06 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.904 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 643' ' ' LEU . . . . . 0.488 HD13 ' OE2' ' A' ' 650' ' ' GLU . 0.7 OUTLIER 178.06 129.81 0.21 Allowed Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.901 179.888 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 644' ' ' PRO . . . . . 0.466 ' HB2' HD11 ' A' ' 651' ' ' LEU . 57.1 Cg_endo -70.98 130.86 18.49 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.413 2.075 . . . . 0.0 112.223 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 645' ' ' LEU . . . . . 0.62 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.4 tp -124.12 151.78 43.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.272 0.558 . . . . 0.0 111.455 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 646' ' ' ILE . . . . . 0.548 HG22 ' HB3' ' A' ' 651' ' ' LEU . 0.8 OUTLIER -149.66 132.9 7.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.614 178.982 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.21 40.95 60.69 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.304 -179.385 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.08 5.43 58.54 Favored Glycine 0 C--N 1.334 0.439 0 C-N-CA 120.989 -0.624 . . . . 0.0 113.875 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -132.26 163.79 27.83 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 117.447 0.624 . . . . 0.0 111.432 -179.115 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 650' ' ' GLU . . . . . 0.62 ' HA ' HD12 ' A' ' 645' ' ' LEU . 3.6 mt-10 -79.29 145.74 33.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.822 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 651' ' ' LEU . . . . . 0.584 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -135.69 145.05 46.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.11 0.481 . . . . 0.0 111.599 -179.57 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.91 112.33 24.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.97 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 6.7 mp -61.08 -33.78 73.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.076 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -64.58 -47.57 78.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.935 0.398 . . . . 0.0 110.942 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 53.3 t -70.34 -33.07 71.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.271 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 656' ' ' PHE . . . . . 0.47 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.3 OUTLIER -69.1 -46.28 68.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.569 179.624 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -58.17 -52.76 64.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.091 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -57.84 -41.34 82.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.823 0.344 . . . . 0.0 110.789 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 659' ' ' LEU . . . . . 0.572 HD21 ' CE ' ' A' ' 681' ' ' MET . 0.2 OUTLIER -55.03 -46.0 75.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.124 179.93 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 660' ' ' ILE . . . . . 0.708 HD11 ' CH2' ' A' ' 675' ' ' TRP . 12.6 mt -63.2 -42.33 96.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.045 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -62.21 -46.15 90.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.114 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 71.4 tt0 -72.86 -9.54 58.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.474 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 1.4 mmm -95.03 36.66 1.19 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.765 0.317 . . . . 0.0 111.125 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 66.91 38.43 92.89 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.364 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 79.96 172.23 43.76 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.453 -179.856 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 666' ' ' MET . . . . . 0.792 ' O ' HG22 ' A' ' 670' ' ' THR . 9.7 tpt -72.15 -27.19 62.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.654 0.264 . . . . 0.0 111.256 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -57.53 -48.85 78.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.437 -179.586 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 668' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -63.19 -42.87 99.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.837 0.351 . . . . 0.0 111.296 -179.68 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 669' ' ' VAL . . . . . 0.651 HG12 ' CD1' ' A' ' 675' ' ' TRP . 40.2 t -61.81 -53.35 49.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.785 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 670' ' ' THR . . . . . 0.792 HG22 ' O ' ' A' ' 666' ' ' MET . 10.1 t -75.75 -49.66 17.53 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -178.615 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 671' ' ' ASP . . . . . 0.436 ' N ' HG23 ' A' ' 670' ' ' THR . 51.2 m-20 -63.09 -51.01 68.28 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -178.672 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 22.6 mt -87.04 10.87 15.17 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 111.895 0.332 . . . . 0.0 111.895 -179.362 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 10.5 ttpp 46.67 77.19 0.09 Allowed 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 120.929 0.395 . . . . 0.0 110.506 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.52 6.71 14.74 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.706 -179.371 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 675' ' ' TRP . . . . . 0.795 ' HA ' HD22 ' A' ' 678' ' ' LEU . 77.1 m95 -65.05 -22.73 67.02 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.7 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -59.16 -51.68 68.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.845 0.355 . . . . 0.0 111.022 -179.519 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 5.1 tptt -78.0 -47.18 19.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.167 0.508 . . . . 0.0 110.193 179.402 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.795 HD22 ' HA ' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -52.97 -46.41 68.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.176 179.297 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 679' ' ' ALA . . . . . 0.655 ' O ' HD13 ' A' ' 684' ' ' ILE . . . -71.27 -35.68 71.45 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.213 179.769 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -52.87 -48.08 67.37 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.778 0.323 . . . . 0.0 110.863 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 681' ' ' MET . . . . . 0.572 ' CE ' HD21 ' A' ' 659' ' ' LEU . 1.8 ttp -65.3 -20.69 66.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.861 179.527 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 682' ' ' LEU . . . . . 0.467 ' HG ' ' CE2' ' A' ' 656' ' ' PHE . 2.1 mm? -80.06 -3.43 48.54 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.523 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 683' ' ' ARG . . . . . 0.808 ' C ' HD12 ' A' ' 684' ' ' ILE . 0.5 OUTLIER 74.89 71.72 0.1 Allowed 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.936 0.398 . . . . 0.0 111.318 179.874 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 684' ' ' ILE . . . . . 0.808 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.8 mp -125.13 138.1 30.98 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.21 179.631 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 685' ' ' PRO . . . . . 0.505 ' HD2' HG23 ' A' ' 684' ' ' ILE . 41.1 Cg_endo -68.42 121.32 8.26 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.364 2.043 . . . . 0.0 112.567 -179.654 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 686' ' ' LYS . . . . . 0.571 ' NZ ' HG23 ' A' ' 687' ' ' THR . 3.0 pptp? -69.76 -18.71 63.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.184 179.79 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 687' ' ' THR . . . . . 0.571 HG23 ' NZ ' ' A' ' 686' ' ' LYS . 0.2 OUTLIER -65.23 -20.47 66.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.299 -179.766 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 688' ' ' ALA . . . . . 0.761 ' HB3' ' HG2' ' A' ' 691' ' ' ARG . . . -65.02 117.65 7.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.899 0.381 . . . . 0.0 110.87 179.778 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.13 7.83 14.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.557 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -138.84 -0.19 1.93 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.442 179.573 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 691' ' ' ARG . . . . . 0.761 ' HG2' ' HB3' ' A' ' 688' ' ' ALA . 2.5 ptt180 -56.48 -33.94 66.45 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.764 0.316 . . . . 0.0 111.068 -179.585 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 692' ' ' LEU . . . . . 0.707 ' O ' HD23 ' A' ' 695' ' ' LEU . 0.5 OUTLIER -70.17 -53.09 18.67 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.927 0.394 . . . . 0.0 110.996 -179.943 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.98 -37.18 69.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.828 0.346 . . . . 0.0 111.565 -179.657 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.44 -41.29 98.67 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.361 -179.495 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 0.713 HD11 ' HB3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -72.95 -40.01 65.73 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.969 -0.293 . . . . 0.0 110.654 179.972 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.509 ' N ' HD23 ' A' ' 695' ' ' LEU . 0.0 OUTLIER -55.33 -44.6 76.02 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.29 0.567 . . . . 0.0 109.752 179.126 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -77.6 -29.46 51.92 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.754 179.075 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 698' ' ' ALA . . . . . 0.415 ' HB3' ' HA ' ' A' ' 695' ' ' LEU . . . -66.78 -40.68 88.26 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.878 -179.647 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 699' ' ' TYR . . . . . 0.558 ' CE2' HD23 ' A' ' 704' ' ' LEU . 2.6 p90 -80.82 -40.4 25.02 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.833 0.349 . . . . 0.0 110.441 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 700' ' ' CYS . . . . . 0.439 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 0.7 OUTLIER -58.86 -33.03 70.0 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.784 179.909 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -94.4 -4.57 48.17 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.68 -179.719 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 702' ' ' TYR . . . . . 0.511 ' CE2' HG21 ' A' ' 638' ' ' ILE . 8.3 m-85 -123.3 -76.58 0.59 Allowed 'General case' 0 C--O 1.231 0.126 0 CA-C-O 120.791 0.329 . . . . 0.0 111.38 -179.786 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 703' ' ' LEU . . . . . 0.433 HD13 HD12 ' A' ' 660' ' ' ILE . 25.5 mt -56.31 -45.95 80.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.488 -179.356 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.558 HD23 ' CE2' ' A' ' 699' ' ' TYR . 0.4 OUTLIER -47.62 -54.34 12.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.956 0.407 . . . . 0.0 111.284 -179.792 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 705' ' ' SER . . . . . 0.415 ' O ' ' HG ' ' A' ' 709' ' ' LEU . 0.1 OUTLIER -54.57 -48.34 72.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.97 -179.846 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 706' ' ' TYR . . . . . 0.524 ' HA ' HD12 ' A' ' 709' ' ' LEU . 46.6 t80 -64.51 -31.61 72.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.052 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -79.57 -16.28 56.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.306 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -97.44 -19.75 18.22 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.771 0.319 . . . . 0.0 111.13 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 709' ' ' LEU . . . . . 0.866 HD11 ' CE1' ' A' ' 632' ' ' HIS . 45.7 mt -55.31 151.36 9.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.998 0.428 . . . . 0.0 111.466 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 710' ' ' SER . . . . . 0.429 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.3 OUTLIER -80.05 171.73 11.66 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.597 179.753 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 711' ' ' PRO . . . . . 0.429 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 60.1 Cg_endo -72.38 -6.75 19.67 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.494 2.129 . . . . 0.0 112.862 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -74.57 -56.62 4.63 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.854 0.359 . . . . 0.0 110.943 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 713' ' ' GLU . . . . . 0.741 ' OE1' HD13 ' A' ' 709' ' ' LEU . 2.8 pp20? -61.06 -25.79 67.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.033 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -73.23 -54.1 9.26 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.167 179.571 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 26.5 ttt180 -60.13 -40.69 90.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.11 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.47 -53.94 12.28 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.324 -179.702 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 717' ' ' LEU . . . . . 0.566 HD12 ' OE1' ' A' ' 713' ' ' GLU . 76.8 mt -60.6 -43.26 97.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.863 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 718' ' ' GLU . . . . . 0.724 ' HG3' HD13 ' A' ' 722' ' ' LEU . 36.3 tt0 -63.86 -54.03 41.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.361 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 10.8 mmtt -50.38 -35.07 26.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.292 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 720' ' ' GLU . . . . . 0.44 ' O ' ' HG2' ' A' ' 723' ' ' MET . 1.5 mm-40 -70.39 -55.31 9.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.981 0.419 . . . . 0.0 110.93 179.866 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 721' ' ' VAL . . . . . 0.553 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 39.2 t -63.77 -55.15 24.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.179 -179.568 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 722' ' ' LEU . . . . . 0.724 HD13 ' HG3' ' A' ' 718' ' ' GLU . 7.1 mp -53.48 -41.94 66.75 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.1 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 723' ' ' MET . . . . . 0.59 ' O ' HD12 ' A' ' 727' ' ' ILE . 5.8 ptp -68.92 -38.83 79.79 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.052 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 724' ' ' GLU . . . . . 0.405 ' N ' ' HG3' ' A' ' 723' ' ' MET . 2.0 mt-10 -59.68 -35.38 74.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.145 -179.793 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 725' ' ' LYS . . . . . 0.447 ' HD3' ' CE2' ' A' ' 619' ' ' TRP . 10.0 pttt -86.15 -37.8 18.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.433 -179.663 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 726' ' ' GLU . . . . . 0.405 ' N ' ' HG3' ' A' ' 725' ' ' LYS . 3.5 mm-40 -70.11 -50.42 40.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.308 -179.524 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 727' ' ' ILE . . . . . 0.647 ' O ' HG22 ' A' ' 727' ' ' ILE . 4.1 mp -88.09 11.64 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.697 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 2.8 tt -57.68 -35.73 70.97 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.835 0.35 . . . . 0.0 110.952 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -63.04 -51.52 66.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.994 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 3.6 mtpt . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.18 -0.914 . . . . 0.0 110.927 -179.941 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.206 0 N-CA-C 112.457 -0.257 . . . . 0.0 112.457 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.59 -28.48 26.04 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.558 2.172 . . . . 0.0 112.291 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 3.1 mt -82.87 177.69 8.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.928 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 95.58 -24.38 29.63 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.608 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 29.2 t 62.91 79.88 0.25 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.806 0.336 . . . . 0.0 110.98 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 615' ' ' LEU . . . . . 0.683 HD13 ' OE1' ' A' ' 729' ' ' GLU . 22.8 mt -68.19 174.31 4.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.862 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 85.3 74.33 1.26 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.506 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -84.12 -1.5 55.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.133 0.492 . . . . 0.0 111.429 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 5.6 mtp180 64.41 130.85 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.873 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 619' ' ' TRP . . . . . 0.551 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.0 OUTLIER -55.41 -22.53 20.5 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.275 -179.913 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 126.99 169.49 12.72 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.424 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -69.19 -33.65 18.27 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.589 2.193 . . . . 0.0 112.195 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 622' ' ' ASN . . . . . 0.556 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 46.6 m-80 -68.25 -43.34 78.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.849 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 623' ' ' VAL . . . . . 0.492 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 38.6 t -71.85 -39.58 67.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.897 179.783 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 624' ' ' GLN . . . . . 0.64 ' CG ' HD11 ' A' ' 722' ' ' LEU . 0.9 OUTLIER -56.55 -50.39 72.03 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.868 179.928 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 625' ' ' ARG . . . . . 0.437 ' NH2' HD11 ' A' ' 629' ' ' ILE . 6.9 mmm180 -64.44 -43.39 94.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.769 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 626' ' ' LEU . . . . . 0.619 HD23 ' O ' ' A' ' 626' ' ' LEU . 4.1 tt -59.65 -36.93 77.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.046 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 627' ' ' ALA . . . . . 0.41 ' CB ' HG11 ' A' ' 721' ' ' VAL . . . -72.36 -45.8 58.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.365 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.1 -47.11 81.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.167 -179.77 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 629' ' ' ILE . . . . . 0.437 HD11 ' NH2' ' A' ' 625' ' ' ARG . 8.5 mt -65.74 -42.49 92.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.098 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.75 -45.16 91.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.169 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 2.1 tttp -59.8 -43.86 94.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.19 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 632' ' ' HIS . . . . . 0.704 ' HB2' HD13 ' A' ' 717' ' ' LEU . 86.3 t60 -68.91 -40.89 78.86 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.119 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.455 HD12 ' CE ' ' A' ' 640' ' ' MET . 46.2 mt -57.49 -47.46 81.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.171 -179.737 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -64.14 -43.25 95.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.827 0.346 . . . . 0.0 110.605 179.726 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 20.2 m -73.67 -11.74 60.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.303 179.642 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 636' ' ' GLN . . . . . 0.403 ' HG3' ' NE2' ' A' ' 632' ' ' HIS . 32.2 mm-40 -97.46 -9.6 26.93 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.654 -179.75 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 118.57 -8.7 13.25 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.268 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 638' ' ' ILE . . . . . 0.502 HG21 ' CZ ' ' A' ' 702' ' ' TYR . 10.4 mt -100.57 104.64 16.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.649 0.261 . . . . 0.0 111.001 -179.78 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.82 109.49 15.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.086 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 640' ' ' MET . . . . . 0.455 ' CE ' HD12 ' A' ' 633' ' ' LEU . 1.6 mtm -113.64 25.15 11.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.82 179.759 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.98 -47.76 49.82 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.865 -179.925 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 642' ' ' GLU . . . . . 0.773 ' O ' HD12 ' A' ' 643' ' ' LEU . 0.2 OUTLIER -49.59 -72.6 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.096 -179.938 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 643' ' ' LEU . . . . . 0.773 HD12 ' O ' ' A' ' 642' ' ' GLU . 0.0 OUTLIER -178.05 117.66 0.25 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.821 179.86 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -67.97 119.82 6.83 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.393 2.062 . . . . 0.0 112.097 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 645' ' ' LEU . . . . . 0.516 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.4 tp -131.15 154.96 47.8 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.402 0.62 . . . . 0.0 111.651 -179.724 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 646' ' ' ILE . . . . . 0.559 HD11 ' HA ' ' A' ' 695' ' ' LEU . 2.3 tt -149.94 134.2 8.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.54 178.966 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 50.14 41.65 38.9 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.214 -0.993 . . . . 0.0 112.12 -179.343 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.16 5.74 54.74 Favored Glycine 0 CA--C 1.522 0.507 0 C-N-CA 121.025 -0.607 . . . . 0.0 113.812 179.428 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -131.82 162.54 30.32 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 117.553 0.677 . . . . 0.0 111.541 -179.089 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 650' ' ' GLU . . . . . 0.516 ' HA ' HD12 ' A' ' 645' ' ' LEU . 5.2 mt-10 -81.38 144.33 31.52 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.85 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 651' ' ' LEU . . . . . 0.617 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.78 145.07 48.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.191 179.988 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -95.27 110.41 22.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.883 -179.92 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 653' ' ' LEU . . . . . 0.444 HD22 ' CD2' ' A' ' 651' ' ' LEU . 4.0 mm? -52.85 -36.07 58.35 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.025 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 654' ' ' ALA . . . . . 0.556 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -69.31 -47.09 65.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.042 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 19.3 t -65.91 -41.78 91.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.629 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 656' ' ' PHE . . . . . 0.423 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.1 OUTLIER -67.37 -44.13 79.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.739 179.805 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -56.52 -51.71 67.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.885 179.898 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 11.2 ttt180 -58.58 -40.85 84.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.773 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 659' ' ' LEU . . . . . 0.49 HD12 ' HB2' ' A' ' 678' ' ' LEU . 0.2 OUTLIER -55.61 -45.62 77.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.102 -179.947 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 660' ' ' ILE . . . . . 0.715 HG23 HG21 ' A' ' 669' ' ' VAL . 33.0 mt -66.11 -44.27 91.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.265 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -61.25 -41.51 97.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.386 -179.615 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -72.3 -10.34 59.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.61 -179.661 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.74 36.58 1.38 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.76 0.314 . . . . 0.0 111.186 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 68.63 28.81 72.91 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.628 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 92.32 171.37 41.26 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.593 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 666' ' ' MET . . . . . 0.575 ' SD ' HG21 ' A' ' 660' ' ' ILE . 10.6 tpt -71.59 -30.87 66.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.758 0.313 . . . . 0.0 111.254 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -55.15 -44.92 75.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.139 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 668' ' ' GLN . . . . . 0.417 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -65.23 -52.19 56.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.898 0.38 . . . . 0.0 110.942 179.922 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 669' ' ' VAL . . . . . 0.715 HG21 HG23 ' A' ' 660' ' ' ILE . 48.7 t -49.02 -54.75 4.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.592 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 670' ' ' THR . . . . . 0.565 HG22 ' O ' ' A' ' 666' ' ' MET . 12.9 t -76.22 -50.68 13.83 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 -178.59 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 671' ' ' ASP . . . . . 0.473 ' N ' HG23 ' A' ' 670' ' ' THR . 70.0 m-20 -61.18 -51.18 70.09 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -177.909 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 672' ' ' LEU . . . . . 0.417 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 10.4 mp -76.22 1.62 15.42 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -178.907 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 2.9 mmmt 50.14 85.19 0.03 OUTLIER 'General case' 0 C--O 1.232 0.138 0 CA-C-O 121.042 0.448 . . . . 0.0 110.387 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 7.4 mtmt -147.88 19.88 1.14 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.209 -179.701 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 675' ' ' TRP . . . . . 1.146 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 26.4 m95 -55.77 -29.24 59.31 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-O 121.428 0.632 . . . . 0.0 110.199 179.816 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -57.34 -42.9 82.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.684 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 11.1 mmtp -76.32 -51.83 11.18 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 111.668 0.248 . . . . 0.0 111.668 -179.269 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 1.046 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -57.32 -41.3 79.68 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 179.528 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 679' ' ' ALA . . . . . 0.782 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.72 -30.01 65.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.208 178.779 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.44 -51.56 66.53 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.295 179.57 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -60.53 -22.5 63.68 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.644 179.405 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 682' ' ' LEU . . . . . 0.413 ' HB2' ' O ' ' A' ' 679' ' ' ALA . 2.5 mm? -78.89 -2.2 38.74 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.445 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 683' ' ' ARG . . . . . 0.739 ' C ' HD12 ' A' ' 684' ' ' ILE . 1.1 mmt180 71.88 71.85 0.16 Allowed 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.962 0.41 . . . . 0.0 110.867 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 684' ' ' ILE . . . . . 0.739 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.7 mp -122.56 135.76 25.96 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.927 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.29 122.59 10.11 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.418 2.078 . . . . 0.0 112.3 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 1.5 mmtm -70.0 -17.28 63.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.245 179.804 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 1.1 p -65.46 -22.81 66.79 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.321 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 688' ' ' ALA . . . . . 0.471 ' HB1' ' HG3' ' A' ' 691' ' ' ARG . . . -84.58 105.18 15.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.871 0.367 . . . . 0.0 110.905 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 -70.49 -68.46 0.43 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.181 -179.595 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -52.76 -19.55 2.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.871 -179.583 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 691' ' ' ARG . . . . . 0.471 ' HG3' ' HB1' ' A' ' 688' ' ' ALA . 0.0 OUTLIER -48.09 -37.1 14.45 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.856 0.36 . . . . 0.0 111.171 179.922 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -64.23 -42.97 96.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.006 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.05 -36.78 69.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.971 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 3.5 tttt -65.67 -41.69 92.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.128 179.602 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 1.146 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.2 OUTLIER -64.59 -41.93 95.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.279 179.51 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.461 ' O ' ' CD1' ' A' ' 699' ' ' TYR . 0.0 OUTLIER -57.85 -44.16 86.36 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.663 179.706 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -77.37 -29.79 53.47 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.128 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 698' ' ' ALA . . . . . 0.437 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.39 -37.68 83.49 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.716 -179.7 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 699' ' ' TYR . . . . . 0.549 ' CZ ' ' HE2' ' A' ' 666' ' ' MET . 2.1 p90 -84.26 -39.06 19.73 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.945 0.402 . . . . 0.0 110.305 179.689 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 700' ' ' CYS . . . . . 0.446 ' HA ' HD23 ' A' ' 704' ' ' LEU . 13.7 t -60.03 -30.54 69.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.567 179.758 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -97.89 -3.49 38.49 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.451 179.865 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 702' ' ' TYR . . . . . 0.502 ' CZ ' HG21 ' A' ' 638' ' ' ILE . 5.3 m-85 -117.98 -74.94 0.59 Allowed 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.862 0.363 . . . . 0.0 111.278 -179.719 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 703' ' ' LEU . . . . . 0.598 ' CD2' HD12 ' A' ' 660' ' ' ILE . 1.1 mp -60.91 -46.8 89.21 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.677 -179.263 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.447 HD23 ' CE2' ' A' ' 699' ' ' TYR . 0.7 OUTLIER -52.76 -50.76 62.86 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.925 0.393 . . . . 0.0 111.072 -179.812 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 705' ' ' SER . . . . . 0.565 ' O ' HD13 ' A' ' 709' ' ' LEU . 0.3 OUTLIER -54.6 -54.84 36.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.719 179.935 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 706' ' ' TYR . . . . . 0.467 ' CE2' ' CE1' ' A' ' 714' ' ' HIS . 23.8 t80 -47.18 -43.12 20.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.97 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -93.79 -0.82 55.67 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.246 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.06 -16.43 56.8 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.453 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 709' ' ' LEU . . . . . 0.583 ' H ' HD13 ' A' ' 709' ' ' LEU . 0.0 OUTLIER -95.71 -173.35 2.84 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.833 0.349 . . . . 0.0 111.51 -179.642 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 710' ' ' SER . . . . . 0.416 ' O ' HD23 ' A' ' 709' ' ' LEU . 0.3 OUTLIER -86.71 165.47 32.35 Favored Pre-proline 0 C--N 1.332 -0.158 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.192 -179.705 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 711' ' ' PRO . . . . . 0.402 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 14.5 Cg_endo -56.87 -18.78 28.93 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.772 2.315 . . . . 0.0 112.972 -179.782 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -60.04 -54.16 49.24 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.93 0.395 . . . . 0.0 110.81 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 713' ' ' GLU . . . . . 0.455 ' HB2' ' HG ' ' A' ' 709' ' ' LEU . 2.7 mm-40 -61.28 -25.93 67.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.932 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 714' ' ' HIS . . . . . 0.467 ' CE1' ' CE2' ' A' ' 706' ' ' TYR . 0.1 OUTLIER -75.59 -54.06 7.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.254 179.529 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 22.5 ttt85 -66.22 -34.12 77.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.202 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 3.0 ttt180 -67.79 -54.28 20.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.841 0.353 . . . . 0.0 110.983 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 717' ' ' LEU . . . . . 0.704 HD13 ' HB2' ' A' ' 632' ' ' HIS . 29.7 mt -64.62 -34.98 79.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.449 179.753 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 718' ' ' GLU . . . . . 0.62 ' HG3' HD13 ' A' ' 722' ' ' LEU . 28.3 tt0 -69.81 -53.81 16.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.405 179.599 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.48 -33.41 54.19 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.562 -179.703 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 720' ' ' GLU . . . . . 0.452 ' O ' ' HG2' ' A' ' 723' ' ' MET . 13.8 mt-10 -70.56 -55.73 8.18 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.036 0.446 . . . . 0.0 110.498 179.823 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 721' ' ' VAL . . . . . 0.551 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 41.4 t -61.66 -51.58 71.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.013 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 722' ' ' LEU . . . . . 0.64 HD11 ' CG ' ' A' ' 624' ' ' GLN . 9.0 mp -56.47 -38.56 71.87 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.921 -179.188 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 723' ' ' MET . . . . . 0.605 ' O ' HD12 ' A' ' 727' ' ' ILE . 16.1 ptp -74.67 -41.34 60.46 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.954 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 724' ' ' GLU . . . . . 0.432 ' N ' ' HG3' ' A' ' 723' ' ' MET . 1.6 mm-40 -56.87 -30.65 64.06 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.156 -179.846 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 725' ' ' LYS . . . . . 0.447 ' HD3' ' CZ2' ' A' ' 619' ' ' TRP . 15.0 pttt -86.19 -43.52 12.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.256 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -66.38 -51.55 55.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.082 -179.77 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 727' ' ' ILE . . . . . 0.632 ' O ' HG22 ' A' ' 727' ' ' ILE . 3.9 mp -87.83 11.66 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.667 -179.826 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 5.4 tt -52.64 -34.0 49.4 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.829 0.347 . . . . 0.0 111.142 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 729' ' ' GLU . . . . . 0.683 ' OE1' HD13 ' A' ' 615' ' ' LEU . 12.6 mt-10 -83.57 -55.59 4.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.891 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 27.3 mtmm . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.27 -0.871 . . . . 0.0 110.932 -179.961 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.203 0 N-CA-C 112.549 -0.22 . . . . 0.0 112.549 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.92 -28.74 24.12 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.568 2.179 . . . . 0.0 112.295 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 3.0 mt -69.74 149.35 48.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.923 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . -83.47 -139.55 3.81 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.526 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 4.9 m 60.24 97.97 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.852 0.358 . . . . 0.0 110.97 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 615' ' ' LEU . . . . . 0.469 HD13 ' CB ' ' A' ' 729' ' ' GLU . 1.6 mt -117.52 -176.3 2.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.855 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 133.01 92.28 0.5 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.564 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.2 120.71 11.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.027 0.442 . . . . 0.0 110.591 179.651 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.44 136.33 33.49 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.864 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 619' ' ' TRP . . . . . 0.507 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.1 OUTLIER -64.1 -15.61 60.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.443 -179.891 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 119.93 161.72 11.65 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.385 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -68.22 -36.19 17.16 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.499 2.133 . . . . 0.0 112.264 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 622' ' ' ASN . . . . . 0.48 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 43.1 m-80 -67.56 -35.86 79.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.856 179.904 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 623' ' ' VAL . . . . . 0.436 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 40.6 t -70.44 -38.48 74.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.618 179.527 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 624' ' ' GLN . . . . . 0.558 ' HG2' HD21 ' A' ' 722' ' ' LEU . 24.6 tp60 -68.17 -34.76 76.9 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.332 179.518 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 625' ' ' ARG . . . . . 0.517 ' O ' HD12 ' A' ' 629' ' ' ILE . 0.1 OUTLIER -63.21 -50.71 69.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.33 179.511 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 8.5 tt -67.35 -33.52 75.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.711 179.644 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -69.09 -46.87 66.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.209 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -59.07 -49.18 78.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.073 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 629' ' ' ILE . . . . . 0.716 HG21 HD23 ' A' ' 653' ' ' LEU . 7.3 mt -62.97 -35.46 71.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.109 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 5.7 ttpt -63.21 -47.85 80.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.069 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.31 -39.25 92.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.08 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 632' ' ' HIS . . . . . 0.791 ' HB2' HD13 ' A' ' 717' ' ' LEU . 78.5 t60 -70.73 -42.58 70.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.161 -179.876 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.587 HD13 ' SD ' ' A' ' 640' ' ' MET . 15.4 mt -58.13 -50.07 74.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.349 -179.559 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.62 -42.36 98.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.796 0.331 . . . . 0.0 110.671 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -73.59 -11.5 60.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.066 179.457 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 636' ' ' GLN . . . . . 0.4 ' CG ' ' CE1' ' A' ' 632' ' ' HIS . 15.6 mm-40 -98.62 -9.32 24.93 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.573 -179.799 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 119.06 -9.04 12.28 Favored Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.467 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 638' ' ' ILE . . . . . 0.648 ' N ' HD12 ' A' ' 638' ' ' ILE . 3.5 mp -100.69 104.65 16.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.748 0.309 . . . . 0.0 111.112 -179.62 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 2.4 m -76.68 113.44 14.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.89 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 640' ' ' MET . . . . . 0.587 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.9 mtp -129.09 31.7 4.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.97 -179.862 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.55 -28.53 69.93 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.043 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 642' ' ' GLU . . . . . 0.475 ' O ' HD12 ' A' ' 643' ' ' LEU . 27.4 mt-10 -79.86 -80.13 0.13 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.041 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 643' ' ' LEU . . . . . 0.475 HD12 ' O ' ' A' ' 642' ' ' GLU . 0.0 OUTLIER -177.54 140.14 0.43 Allowed Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.876 -179.972 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 644' ' ' PRO . . . . . 0.46 ' HB2' HD11 ' A' ' 651' ' ' LEU . 72.4 Cg_endo -77.02 147.36 26.61 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.588 2.192 . . . . 0.0 112.481 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 645' ' ' LEU . . . . . 0.65 HD12 ' HA ' ' A' ' 650' ' ' GLU . 5.1 tp -136.04 150.51 49.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.131 0.491 . . . . 0.0 110.965 179.675 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 646' ' ' ILE . . . . . 0.767 HD11 ' HA ' ' A' ' 695' ' ' LEU . 0.6 OUTLIER -147.85 132.19 9.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.701 179.249 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.31 41.79 62.86 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.317 -0.944 . . . . 0.0 112.345 -179.367 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 69.52 7.49 58.09 Favored Glycine 0 C--N 1.332 0.348 0 C-N-CA 121.0 -0.619 . . . . 0.0 113.779 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.7 m -132.97 163.76 28.48 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 117.358 0.579 . . . . 0.0 111.434 -179.268 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 650' ' ' GLU . . . . . 0.65 ' HA ' HD12 ' A' ' 645' ' ' LEU . 1.1 mp0 -79.66 144.54 33.65 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.708 179.809 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 651' ' ' LEU . . . . . 0.603 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -135.11 144.93 47.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.125 0.488 . . . . 0.0 111.357 -179.661 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.9 107.26 19.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.856 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 653' ' ' LEU . . . . . 0.716 HD23 HG21 ' A' ' 629' ' ' ILE . 7.2 mp -55.03 -40.21 69.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.959 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 654' ' ' ALA . . . . . 0.48 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -59.19 -43.45 92.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.98 179.842 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 5.6 t -72.16 -43.03 65.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.613 179.724 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 656' ' ' PHE . . . . . 0.435 ' CE2' ' HG ' ' A' ' 682' ' ' LEU . 0.3 OUTLIER -60.45 -46.37 90.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.754 179.801 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -60.6 -49.5 77.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.936 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.1 -43.22 99.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.946 -179.939 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 659' ' ' LEU . . . . . 0.469 HD22 ' O ' ' A' ' 678' ' ' LEU . 0.2 OUTLIER -57.55 -39.85 77.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.161 -179.87 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 660' ' ' ILE . . . . . 0.746 HD11 ' CH2' ' A' ' 675' ' ' TRP . 83.1 mt -69.01 -43.71 81.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.785 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.35 -43.35 94.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.051 -179.809 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -69.81 -13.73 62.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.355 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 1.2 ttm -94.27 21.18 7.24 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.29 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 95.44 -2.77 65.45 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.61 -0.805 . . . . 0.0 113.124 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 116.06 178.47 18.26 Favored Glycine 0 C--N 1.332 0.314 0 C-N-CA 120.539 -0.839 . . . . 0.0 112.446 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 666' ' ' MET . . . . . 0.705 ' HG2' HG21 ' A' ' 660' ' ' ILE . 0.0 OUTLIER -71.55 -30.85 66.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.862 0.363 . . . . 0.0 110.911 179.896 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 667' ' ' GLN . . . . . 0.401 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 19.0 pt20 -57.79 -48.74 78.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.458 -179.725 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 668' ' ' GLN . . . . . 0.415 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 11.6 mm100 -62.37 -52.41 63.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.864 0.364 . . . . 0.0 111.334 -179.637 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 669' ' ' VAL . . . . . 0.613 HG21 HG23 ' A' ' 660' ' ' ILE . 73.4 t -51.4 -55.78 7.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.936 -179.646 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 670' ' ' THR . . . . . 0.526 HG22 ' O ' ' A' ' 666' ' ' MET . 8.0 t -76.09 -50.03 15.83 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 -178.099 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 671' ' ' ASP . . . . . 0.477 ' N ' HG23 ' A' ' 670' ' ' THR . 5.7 t70 -61.6 -51.15 69.72 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -177.842 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 672' ' ' LEU . . . . . 0.415 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 8.8 mp -78.59 2.7 18.42 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 -178.915 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 48.77 86.6 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.994 0.426 . . . . 0.0 110.485 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -149.15 21.75 0.96 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.077 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 675' ' ' TRP . . . . . 1.072 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 36.2 m95 -59.02 -27.98 65.98 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.447 0.641 . . . . 0.0 110.093 179.706 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -56.54 -42.79 79.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.542 -179.661 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.58 -51.62 11.28 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.784 0.326 . . . . 0.0 111.419 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.972 HD22 ' HA ' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.49 -39.73 70.8 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 179.693 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 679' ' ' ALA . . . . . 0.845 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.94 -34.65 69.2 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.507 179.154 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -53.24 -48.5 68.16 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.433 179.628 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.14 -21.42 66.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.769 179.37 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 682' ' ' LEU . . . . . 0.541 HD23 ' O ' ' A' ' 678' ' ' LEU . 3.6 mm? -78.9 -1.41 35.0 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.496 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 683' ' ' ARG . . . . . 0.675 ' C ' HD12 ' A' ' 684' ' ' ILE . 3.5 mpt_? 68.5 71.81 0.29 Allowed 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.94 0.4 . . . . 0.0 111.489 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 684' ' ' ILE . . . . . 0.675 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.9 mp -123.97 136.02 26.99 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.273 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -63.25 125.33 15.52 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.418 2.079 . . . . 0.0 112.414 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.77 -16.05 63.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.102 179.839 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.57 -23.95 66.97 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.216 -179.787 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 688' ' ' ALA . . . . . 0.471 ' HB1' ' HB3' ' A' ' 691' ' ' ARG . . . -77.84 115.68 17.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.859 0.361 . . . . 0.0 110.769 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -76.18 -68.24 0.6 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.376 -179.456 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 56.9 m-20 -57.76 -11.67 2.41 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 691' ' ' ARG . . . . . 0.484 ' CG ' HD22 ' A' ' 692' ' ' LEU . 4.9 ptt-85 -50.32 -32.44 17.12 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.791 0.329 . . . . 0.0 111.049 -179.843 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 692' ' ' LEU . . . . . 0.484 HD22 ' CG ' ' A' ' 691' ' ' ARG . 2.9 mm? -68.17 -50.39 54.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.925 -179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.03 -37.31 69.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.039 179.89 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 694' ' ' LYS . . . . . 0.408 ' O ' ' HB2' ' A' ' 698' ' ' ALA . 1.3 mtpt -63.28 -37.83 88.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.243 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 1.072 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.5 OUTLIER -68.77 -44.26 74.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.484 179.74 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.449 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 31.8 tt0 -55.37 -47.7 75.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.748 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 71.1 mt-10 -77.11 -29.61 54.91 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.834 179.615 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 698' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' A' ' 694' ' ' LYS . . . -66.46 -38.03 86.44 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.46 -179.901 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 699' ' ' TYR . . . . . 0.499 ' CD2' ' CZ2' ' A' ' 675' ' ' TRP . 1.0 OUTLIER -85.92 -30.53 22.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.893 0.378 . . . . 0.0 110.496 179.862 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 700' ' ' CYS . . . . . 0.467 ' HA ' HD23 ' A' ' 704' ' ' LEU . 15.4 t -66.84 -30.51 70.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.644 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -99.49 -2.32 36.24 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.478 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 702' ' ' TYR . . . . . 0.405 ' CD1' ' O ' ' A' ' 698' ' ' ALA . 6.2 m-85 -117.68 -78.27 0.58 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.802 0.334 . . . . 0.0 111.214 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 75.7 mt -57.71 -43.74 85.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.464 -179.542 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.467 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.6 OUTLIER -55.08 -52.22 63.89 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.881 0.372 . . . . 0.0 111.008 -179.921 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 705' ' ' SER . . . . . 0.601 ' O ' HD13 ' A' ' 709' ' ' LEU . 59.7 p -54.37 -55.0 32.98 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.665 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 706' ' ' TYR . . . . . 0.442 ' HA ' ' CD2' ' A' ' 632' ' ' HIS . 9.7 t80 -46.9 -43.07 18.57 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.845 -179.571 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -94.03 0.02 55.72 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -179.48 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 22.6 t -79.19 -18.47 52.94 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -179.441 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 709' ' ' LEU . . . . . 0.601 HD13 ' O ' ' A' ' 705' ' ' SER . 0.0 OUTLIER -94.16 -173.92 3.23 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.831 0.348 . . . . 0.0 111.406 -179.815 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 710' ' ' SER . . . . . 0.407 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.3 OUTLIER -85.45 165.97 33.0 Favored Pre-proline 0 C--N 1.332 -0.181 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.048 -179.804 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 711' ' ' PRO . . . . . 0.407 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 18.0 Cg_endo -57.89 -18.93 37.12 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.625 2.217 . . . . 0.0 112.734 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -60.91 -54.27 47.06 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.913 0.387 . . . . 0.0 110.72 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 713' ' ' GLU . . . . . 0.419 ' HB2' ' HG ' ' A' ' 709' ' ' LEU . 18.6 mm-40 -60.41 -26.06 66.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.832 179.662 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -75.61 -53.86 7.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.114 179.255 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 6.2 mmm180 -64.65 -33.02 74.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.07 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 3.3 mtt180 -67.47 -54.28 21.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.867 0.365 . . . . 0.0 110.805 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 717' ' ' LEU . . . . . 0.791 HD13 ' HB2' ' A' ' 632' ' ' HIS . 25.9 mt -64.12 -37.47 87.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.478 179.63 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 718' ' ' GLU . . . . . 0.575 ' HG3' HD23 ' A' ' 722' ' ' LEU . 25.5 tt0 -67.63 -53.92 23.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.357 179.605 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.3 -34.76 48.16 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.497 -179.758 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 720' ' ' GLU . . . . . 0.408 ' O ' ' HG2' ' A' ' 723' ' ' MET . 1.2 mm-40 -67.69 -55.85 11.62 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.06 0.457 . . . . 0.0 110.279 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 721' ' ' VAL . . . . . 0.507 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 44.2 t -60.78 -50.96 78.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.638 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 722' ' ' LEU . . . . . 0.575 HD23 ' HG3' ' A' ' 718' ' ' GLU . 2.2 mm? -48.79 -46.39 41.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.907 -179.354 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 723' ' ' MET . . . . . 0.578 ' O ' HD12 ' A' ' 727' ' ' ILE . 18.0 ptp -73.99 -40.77 62.72 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.098 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -50.76 -41.53 56.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.759 -179.199 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 725' ' ' LYS . . . . . 0.519 ' NZ ' HD13 ' A' ' 722' ' ' LEU . 0.0 OUTLIER -83.23 -40.2 19.93 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.65 0.262 . . . . 0.0 111.271 -179.687 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -60.56 -52.99 62.84 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.968 0.413 . . . . 0.0 110.836 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 727' ' ' ILE . . . . . 0.616 ' O ' HG22 ' A' ' 727' ' ' ILE . 4.2 mp -89.82 11.62 2.0 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.558 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 6.6 tt -53.87 -42.47 68.64 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.847 0.356 . . . . 0.0 111.152 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 729' ' ' GLU . . . . . 0.469 ' CB ' HD13 ' A' ' 615' ' ' LEU . 2.9 mt-10 -71.98 -70.64 0.32 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.962 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 730' ' ' LYS . . . . . 0.522 ' NZ ' HG23 ' A' ' 727' ' ' ILE . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.96 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.177 0 N-CA-C 112.535 -0.226 . . . . 0.0 112.535 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -52.33 -35.22 63.67 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.566 2.177 . . . . 0.0 112.341 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.88 175.86 6.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.907 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . -155.23 96.18 0.16 Allowed Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.497 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.37 33.15 1.49 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.818 0.342 . . . . 0.0 110.881 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 26.6 mt -68.97 156.79 37.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.924 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 616' ' ' GLY . . . . . 0.417 ' O ' ' HD2' ' A' ' 617' ' ' ARG . . . -110.94 -61.27 0.48 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.529 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 617' ' ' ARG . . . . . 0.422 ' HD2' ' HA ' ' A' ' 617' ' ' ARG . 24.5 mmm180 -156.85 124.56 5.44 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.935 0.398 . . . . 0.0 110.888 179.958 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.05 127.48 14.98 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.876 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 619' ' ' TRP . . . . . 0.572 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.1 OUTLIER -64.66 -14.85 60.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.439 -179.948 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 118.53 161.32 11.78 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.373 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -67.47 -39.81 11.76 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.497 2.131 . . . . 0.0 112.332 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 622' ' ' ASN . . . . . 0.474 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 11.6 p30 -65.08 -35.97 82.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.941 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 623' ' ' VAL . . . . . 0.429 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 42.1 t -67.81 -43.62 86.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.751 179.686 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 624' ' ' GLN . . . . . 0.524 ' HG2' HD11 ' A' ' 722' ' ' LEU . 40.9 tp60 -59.49 -42.68 92.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.526 179.686 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -58.66 -50.75 72.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.429 179.596 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 626' ' ' LEU . . . . . 0.485 HD23 ' O ' ' A' ' 626' ' ' LEU . 6.6 tt -65.7 -28.31 68.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.79 179.611 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 627' ' ' ALA . . . . . 0.411 ' HA ' ' HG2' ' A' ' 630' ' ' LYS . . . -71.4 -52.56 17.89 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.587 -179.775 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 29.5 p -60.84 -38.63 86.18 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.396 -179.533 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 629' ' ' ILE . . . . . 0.636 HG21 HD23 ' A' ' 653' ' ' LEU . 51.3 mt -66.72 -45.54 87.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.329 -179.728 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 630' ' ' LYS . . . . . 0.411 ' HG2' ' HA ' ' A' ' 627' ' ' ALA . 43.8 pttt -66.24 -33.89 76.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.722 0.296 . . . . 0.0 110.987 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 2.0 tttm -67.35 -46.8 72.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.014 0.435 . . . . 0.0 110.79 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 632' ' ' HIS . . . . . 0.704 ' HB2' HD13 ' A' ' 717' ' ' LEU . 86.6 t60 -67.28 -39.61 86.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.734 179.77 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.626 HD23 HD13 ' A' ' 638' ' ' ILE . 21.8 mt -57.82 -48.99 78.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.047 -179.903 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 634' ' ' ARG . . . . . 0.421 ' HG3' ' N ' ' A' ' 635' ' ' SER . 0.1 OUTLIER -63.16 -40.6 98.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.831 179.974 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 635' ' ' SER . . . . . 0.421 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 1.6 m -73.68 -19.93 60.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.219 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 23.6 tp60 -90.58 -7.45 52.79 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.677 -179.716 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 117.92 -13.12 12.98 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.478 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 638' ' ' ILE . . . . . 0.626 HD13 HD23 ' A' ' 633' ' ' LEU . 2.8 mp -94.38 104.59 15.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 120.608 0.242 . . . . 0.0 111.219 -179.716 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -77.56 121.34 23.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.837 0.351 . . . . 0.0 111.007 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 640' ' ' MET . . . . . 0.413 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.9 ttp -133.02 30.19 4.0 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.882 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -65.56 -33.99 77.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.872 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -69.59 -77.39 0.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.846 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 643' ' ' LEU . . . . . 0.445 ' O ' HD12 ' A' ' 643' ' ' LEU . 1.4 pp -179.98 136.68 0.28 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.873 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.81 121.01 7.0 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.499 2.132 . . . . 0.0 112.168 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 645' ' ' LEU . . . . . 0.633 HD12 ' HA ' ' A' ' 650' ' ' GLU . 5.0 tp -119.88 149.52 41.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.221 0.534 . . . . 0.0 111.287 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 646' ' ' ILE . . . . . 0.531 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.2 tt -144.83 130.15 14.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.45 178.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 647' ' ' GLY . . . . . 0.408 ' O ' ' NH1' ' A' ' 691' ' ' ARG . . . 51.91 47.0 54.82 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.269 -0.967 . . . . 0.0 112.086 -179.157 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 64.79 7.67 30.2 Favored Glycine 0 CA--C 1.521 0.421 0 C-N-CA 121.034 -0.603 . . . . 0.0 113.899 179.355 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 98.7 m -129.73 161.7 30.08 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 117.592 0.696 . . . . 0.0 111.516 -179.21 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 650' ' ' GLU . . . . . 0.633 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.8 OUTLIER -81.19 142.55 33.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.638 179.659 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 651' ' ' LEU . . . . . 0.62 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.9 144.72 47.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.041 0.448 . . . . 0.0 111.309 -179.737 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -94.16 109.18 20.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.782 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 653' ' ' LEU . . . . . 0.636 HD23 HG21 ' A' ' 629' ' ' ILE . 6.3 mp -56.67 -35.41 68.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.867 -180.0 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 654' ' ' ALA . . . . . 0.474 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -65.09 -46.81 79.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.958 179.806 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 46.9 t -70.58 -32.66 70.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.562 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 656' ' ' PHE . . . . . 0.484 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.2 OUTLIER -70.55 -46.07 64.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.81 179.881 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -60.14 -49.98 75.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.933 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 658' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 658' ' ' ARG . 0.9 OUTLIER -58.23 -43.99 88.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.963 -179.954 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.49 -48.01 80.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.253 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 660' ' ' ILE . . . . . 0.712 HG21 ' HG2' ' A' ' 666' ' ' MET . 23.3 mt -56.85 -45.73 83.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.916 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -64.68 -47.19 79.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.029 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -62.38 -16.75 56.51 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.441 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 663' ' ' MET . . . . . 0.413 ' CE ' ' HB3' ' A' ' 678' ' ' LEU . 0.1 OUTLIER -94.25 31.86 1.63 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.67 0.272 . . . . 0.0 111.295 -179.826 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 76.15 42.37 24.24 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.824 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 78.21 172.76 40.55 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.707 179.774 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 666' ' ' MET . . . . . 0.712 ' HG2' HG21 ' A' ' 660' ' ' ILE . 0.0 OUTLIER -73.13 -33.66 65.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.769 0.319 . . . . 0.0 111.322 179.963 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 16.0 pt20 -53.05 -43.76 66.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.322 -179.709 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 668' ' ' GLN . . . . . 0.452 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -64.66 -52.48 57.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.972 0.415 . . . . 0.0 110.707 -179.968 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 669' ' ' VAL . . . . . 0.63 HG21 HG23 ' A' ' 660' ' ' ILE . 90.6 t -49.28 -55.52 4.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.567 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 670' ' ' THR . . . . . 0.56 HG22 ' O ' ' A' ' 666' ' ' MET . 8.8 t -76.19 -51.47 12.05 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -178.467 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 671' ' ' ASP . . . . . 0.492 ' N ' HG23 ' A' ' 670' ' ' THR . 4.8 t70 -63.72 -51.3 65.59 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -177.658 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 672' ' ' LEU . . . . . 0.452 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 9.3 mp -77.3 3.34 13.23 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -179.039 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 49.02 86.35 0.03 OUTLIER 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.966 0.412 . . . . 0.0 110.509 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 21.0 mttt -146.2 21.91 1.37 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.261 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 675' ' ' TRP . . . . . 1.107 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 42.5 m95 -60.91 -28.57 69.02 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 121.401 0.619 . . . . 0.0 110.167 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 676' ' ' ASN . . . . . 0.637 ' CG ' HD11 ' A' ' 692' ' ' LEU . 49.4 m-80 -55.76 -43.84 77.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.534 -179.69 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 2.7 ttmm -77.09 -51.53 10.88 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 120.769 0.318 . . . . 0.0 111.4 -179.49 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.976 HD22 ' HA ' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -54.92 -41.25 70.75 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 179.65 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 679' ' ' ALA . . . . . 0.826 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.78 -34.51 69.48 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.766 179.283 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -53.17 -47.67 68.61 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.394 179.798 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 20.1 mtm -64.67 -21.57 66.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.764 179.383 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 682' ' ' LEU . . . . . 0.5 ' O ' ' HB2' ' A' ' 683' ' ' ARG . 3.2 mm? -80.11 -2.08 42.94 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.464 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 683' ' ' ARG . . . . . 0.815 ' C ' HD12 ' A' ' 684' ' ' ILE . 0.2 OUTLIER 72.34 71.76 0.15 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.925 0.393 . . . . 0.0 111.7 179.81 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 684' ' ' ILE . . . . . 0.815 HD12 ' C ' ' A' ' 683' ' ' ARG . 2.1 mp -129.22 139.95 37.2 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.062 179.406 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 685' ' ' PRO . . . . . 0.579 ' HD2' HG23 ' A' ' 684' ' ' ILE . 41.0 Cg_endo -66.83 124.81 12.79 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.303 2.002 . . . . 0.0 112.381 -179.745 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -19.18 63.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.19 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.34 -18.81 65.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.384 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 688' ' ' ALA . . . . . 0.43 ' CB ' ' NE ' ' A' ' 691' ' ' ARG . . . -84.47 107.08 16.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.863 0.363 . . . . 0.0 111.056 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -70.82 -67.77 0.48 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.06 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 45.1 m-20 -48.96 -20.93 0.57 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.972 -179.605 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 691' ' ' ARG . . . . . 0.43 ' NE ' ' CB ' ' A' ' 688' ' ' ALA . 1.4 ttm180 -46.37 -40.35 11.83 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.803 0.335 . . . . 0.0 111.297 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 692' ' ' LEU . . . . . 0.637 HD11 ' CG ' ' A' ' 676' ' ' ASN . 4.5 mm? -63.15 -46.46 87.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.183 -179.758 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.15 -38.67 69.13 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.774 0.321 . . . . 0.0 111.233 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 16.4 mmtt -63.54 -42.19 98.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.989 0.424 . . . . 0.0 110.339 179.758 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 1.107 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.2 OUTLIER -66.84 -40.67 88.04 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.404 179.646 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.425 ' O ' ' CD2' ' A' ' 699' ' ' TYR . 8.9 mt-30 -57.74 -44.98 86.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.788 179.733 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -77.31 -29.81 53.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.203 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 698' ' ' ALA . . . . . 0.4 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.28 -38.36 84.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.653 -179.704 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 699' ' ' TYR . . . . . 0.576 ' HB2' HD12 ' A' ' 703' ' ' LEU . 1.8 p90 -83.65 -37.23 23.1 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.864 0.364 . . . . 0.0 110.484 179.875 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 700' ' ' CYS . . . . . 0.562 ' HA ' HD23 ' A' ' 704' ' ' LEU . 6.8 t -62.18 -30.64 71.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.553 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -95.83 -3.49 45.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.32 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 702' ' ' TYR . . . . . 0.4 ' CD1' ' O ' ' A' ' 698' ' ' ALA . 10.1 m-85 -118.46 -78.53 0.58 Allowed 'General case' 0 CA--C 1.529 0.14 0 CA-C-O 120.849 0.356 . . . . 0.0 111.59 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 703' ' ' LEU . . . . . 0.576 HD12 ' HB2' ' A' ' 699' ' ' TYR . 23.2 mt -60.22 -43.85 95.68 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.966 -179.069 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.562 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.4 OUTLIER -47.9 -56.65 7.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.82 0.343 . . . . 0.0 111.647 -179.442 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 42.3 p -54.4 -48.57 71.43 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.405 -179.457 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 706' ' ' TYR . . . . . 0.596 ' O ' HD22 ' A' ' 709' ' ' LEU . 57.3 t80 -65.51 -29.21 69.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.529 -179.591 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -96.95 0.64 49.24 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -179.438 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 39.8 t -115.54 -12.77 11.6 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 111.771 0.285 . . . . 0.0 111.771 -179.53 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 709' ' ' LEU . . . . . 0.596 HD22 ' O ' ' A' ' 706' ' ' TYR . 0.3 OUTLIER -79.71 179.46 7.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.743 0.306 . . . . 0.0 111.04 -179.969 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -75.04 164.45 61.28 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.143 -179.85 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -68.87 -25.94 32.41 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.645 2.23 . . . . 0.0 112.203 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -50.55 -49.83 55.04 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.748 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 713' ' ' GLU . . . . . 0.585 ' HB2' HD11 ' A' ' 709' ' ' LEU . 1.5 mm-40 -59.89 -27.24 66.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.024 179.848 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 714' ' ' HIS . . . . . 0.555 ' CD2' HD21 ' A' ' 709' ' ' LEU . 12.8 m170 -76.14 -54.03 7.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.501 179.484 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.16 -44.25 97.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.437 -179.614 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 20.8 mtp85 -66.19 -54.18 28.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.223 -179.537 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 717' ' ' LEU . . . . . 0.704 HD13 ' HB2' ' A' ' 632' ' ' HIS . 53.1 mt -62.64 -39.54 94.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.674 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -67.33 -54.03 24.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.33 179.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -50.53 -34.7 26.39 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.337 -179.791 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 720' ' ' GLU . . . . . 0.429 ' O ' ' HG2' ' A' ' 723' ' ' MET . 0.5 OUTLIER -69.39 -55.43 10.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.005 0.431 . . . . 0.0 110.561 179.626 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 721' ' ' VAL . . . . . 0.634 HG23 ' O ' ' A' ' 717' ' ' LEU . 16.8 t -62.03 -54.94 27.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.156 -179.859 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 722' ' ' LEU . . . . . 0.524 HD11 ' HG2' ' A' ' 624' ' ' GLN . 1.2 mp -50.51 -44.18 56.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.009 -179.266 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 723' ' ' MET . . . . . 0.622 ' O ' HD12 ' A' ' 727' ' ' ILE . 16.9 ptp -71.44 -40.31 70.47 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.496 -0.481 . . . . 0.0 110.024 179.719 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 724' ' ' GLU . . . . . 0.4 ' N ' ' HG3' ' A' ' 723' ' ' MET . 5.6 mm-40 -57.49 -31.58 66.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.381 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 725' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.14 -43.14 13.28 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.404 -179.67 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -66.52 -48.93 68.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.834 0.349 . . . . 0.0 111.193 -179.699 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 727' ' ' ILE . . . . . 0.631 ' O ' HG22 ' A' ' 727' ' ' ILE . 3.9 mp -88.96 11.67 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.534 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 5.6 tt -57.38 -36.41 71.21 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.789 0.328 . . . . 0.0 111.028 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -64.57 -68.65 0.34 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.934 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.895 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.231 0 N-CA-C 112.428 -0.269 . . . . 0.0 112.428 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.23 -37.36 5.98 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.572 2.181 . . . . 0.0 112.303 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -80.9 -178.95 7.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.909 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . -159.86 -93.74 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.484 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 24.4 t -171.48 35.76 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.827 0.346 . . . . 0.0 110.922 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 16.4 mt -83.21 158.81 22.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.908 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -141.54 56.02 0.6 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.462 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 3.5 mtp180 -99.41 -1.96 37.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.198 0.523 . . . . 0.0 111.564 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.49 156.09 44.02 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.986 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 619' ' ' TRP . . . . . 0.541 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.0 OUTLIER -83.28 -17.85 41.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.258 179.913 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 123.44 163.25 11.71 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.443 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -66.75 -39.11 15.93 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.542 2.162 . . . . 0.0 112.118 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 622' ' ' ASN . . . . . 0.668 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 6.0 p30 -63.15 -39.25 94.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.888 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 623' ' ' VAL . . . . . 0.465 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 38.8 t -73.29 -35.32 46.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.781 179.701 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 624' ' ' GLN . . . . . 0.656 ' CG ' HD11 ' A' ' 722' ' ' LEU . 0.7 OUTLIER -60.2 -42.43 95.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.689 179.707 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 4.8 tpp180 -69.32 -48.54 61.17 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.72 179.781 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 8.1 tt -61.45 -30.74 70.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.828 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 627' ' ' ALA . . . . . 0.479 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -72.02 -50.63 26.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.201 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -57.2 -46.94 82.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.999 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 629' ' ' ILE . . . . . 0.655 HG21 HD23 ' A' ' 653' ' ' LEU . 12.6 mt -64.47 -39.2 84.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.91 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 630' ' ' LYS . . . . . 0.487 ' HA ' HD12 ' A' ' 633' ' ' LEU . 10.6 ttpt -60.77 -49.73 76.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.738 179.89 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 9.5 tttm -59.5 -38.17 80.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.75 179.854 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 632' ' ' HIS . . . . . 0.578 ' CE1' ' HG3' ' A' ' 636' ' ' GLN . 28.7 t-80 -70.08 -44.25 69.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.83 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 633' ' ' LEU . . . . . 0.662 HD13 ' SD ' ' A' ' 640' ' ' MET . 10.6 mt -55.89 -50.2 71.3 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.369 -179.552 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.92 -41.8 97.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.765 0.317 . . . . 0.0 110.75 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 6.7 t -73.5 -11.5 60.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.958 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 636' ' ' GLN . . . . . 0.578 ' HG3' ' CE1' ' A' ' 632' ' ' HIS . 35.5 mm-40 -99.04 -10.59 22.41 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.551 -179.838 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 117.12 -0.83 19.31 Favored Glycine 0 C--N 1.332 0.34 0 C-N-CA 120.581 -0.819 . . . . 0.0 112.623 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 638' ' ' ILE . . . . . 0.415 HG21 ' CE2' ' A' ' 702' ' ' TYR . 13.8 mt -108.44 109.94 30.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 120.712 0.292 . . . . 0.0 111.327 -179.47 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 5.1 m -83.81 115.06 22.05 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.861 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 640' ' ' MET . . . . . 0.662 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.6 mtp -125.38 30.73 5.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.964 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -64.02 -30.76 71.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.956 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -74.51 -80.09 0.08 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.957 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 643' ' ' LEU . . . . . 0.417 HD12 ' HA ' ' A' ' 643' ' ' LEU . 8.7 tp -179.08 132.09 0.27 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.845 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 644' ' ' PRO . . . . . 0.54 ' HB2' HD11 ' A' ' 651' ' ' LEU . 66.2 Cg_endo -74.49 137.86 23.55 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.481 2.121 . . . . 0.0 112.279 179.937 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 645' ' ' LEU . . . . . 0.636 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.8 tp -129.19 151.6 49.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.187 0.518 . . . . 0.0 111.236 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 646' ' ' ILE . . . . . 0.665 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.3 tt -149.64 133.51 8.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.873 179.086 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 54.64 38.35 63.46 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.342 -0.933 . . . . 0.0 112.221 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.05 7.92 63.59 Favored Glycine 0 C--N 1.333 0.377 0 C-N-CA 120.924 -0.655 . . . . 0.0 113.595 179.353 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 2.1 m -133.73 163.89 28.45 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 117.315 0.557 . . . . 0.0 111.424 -179.282 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 650' ' ' GLU . . . . . 0.636 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.3 OUTLIER -78.28 145.52 35.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.669 179.679 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 651' ' ' LEU . . . . . 0.609 ' C ' HD22 ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.79 145.0 47.97 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.085 0.469 . . . . 0.0 111.466 -179.615 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -96.85 109.25 21.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.725 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 653' ' ' LEU . . . . . 0.655 HD23 HG21 ' A' ' 629' ' ' ILE . 8.2 mp -53.85 -35.29 61.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.949 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 654' ' ' ALA . . . . . 0.668 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -65.02 -43.57 92.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.007 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 49.6 t -72.87 -33.6 66.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.655 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 656' ' ' PHE . . . . . 0.44 ' CE2' ' HG ' ' A' ' 682' ' ' LEU . 0.3 OUTLIER -71.47 -47.92 52.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.805 179.891 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -59.45 -49.16 78.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.893 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 22.2 tpp180 -59.66 -41.93 91.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.868 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 659' ' ' LEU . . . . . 0.752 HD22 ' CD2' ' A' ' 682' ' ' LEU . 0.1 OUTLIER -58.5 -49.18 78.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.103 -179.825 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 660' ' ' ILE . . . . . 0.685 HG23 HG21 ' A' ' 669' ' ' VAL . 27.9 mt -56.79 -45.66 83.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.791 0.329 . . . . 0.0 110.819 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -62.73 -42.31 99.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.884 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -72.11 -11.02 60.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.307 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 663' ' ' MET . . . . . 0.525 ' HE1' ' HB3' ' A' ' 678' ' ' LEU . 0.6 OUTLIER -96.49 32.3 2.05 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.806 0.336 . . . . 0.0 111.047 -179.876 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 75.06 36.55 45.93 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.602 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 665' ' ' GLY . . . . . 0.426 ' O ' HG23 ' A' ' 669' ' ' VAL . . . 82.49 171.23 46.46 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.53 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 666' ' ' MET . . . . . 0.707 ' O ' HG22 ' A' ' 670' ' ' THR . 0.0 OUTLIER -72.49 -32.82 66.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.839 0.352 . . . . 0.0 111.035 179.962 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 27.5 tt0 -54.13 -48.88 70.32 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.193 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 668' ' ' GLN . . . . . 0.447 ' HG3' HD13 ' A' ' 672' ' ' LEU . 0.1 OUTLIER -63.5 -50.63 68.88 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.827 0.346 . . . . 0.0 111.321 -179.632 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 669' ' ' VAL . . . . . 0.685 HG21 HG23 ' A' ' 660' ' ' ILE . 57.2 t -49.04 -52.66 9.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.917 0.389 . . . . 0.0 111.159 179.881 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 670' ' ' THR . . . . . 0.707 HG22 ' O ' ' A' ' 666' ' ' MET . 7.6 t -76.3 -53.92 7.51 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -178.853 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 671' ' ' ASP . . . . . 0.468 ' N ' HG23 ' A' ' 670' ' ' THR . 23.6 m-20 -60.2 -51.41 69.68 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 -177.751 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 672' ' ' LEU . . . . . 0.447 HD13 ' HG3' ' A' ' 668' ' ' GLN . 6.9 mp -75.96 1.66 14.69 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -178.961 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 49.54 82.17 0.05 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.999 0.428 . . . . 0.0 110.297 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 11.1 ttpt -142.19 23.4 2.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.272 -179.517 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 675' ' ' TRP . . . . . 1.1 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 38.5 m95 -62.49 -28.54 69.9 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 121.361 0.6 . . . . 0.0 110.21 179.809 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -56.69 -44.41 81.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.49 -179.643 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.11 -51.51 12.07 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 120.814 0.34 . . . . 0.0 111.267 -179.602 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 678' ' ' LEU . . . . . 0.98 HD22 ' HA ' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.21 -40.44 70.79 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 179.523 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 679' ' ' ALA . . . . . 0.839 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.64 -33.9 69.32 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.59 179.188 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -53.54 -48.73 68.81 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.484 179.638 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 2.4 mtm -64.12 -20.02 65.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.968 179.463 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 682' ' ' LEU . . . . . 0.752 ' CD2' HD22 ' A' ' 659' ' ' LEU . 3.7 mm? -81.85 -0.98 45.98 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.513 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 683' ' ' ARG . . . . . 0.647 ' C ' HD12 ' A' ' 684' ' ' ILE . 5.1 mmm180 66.84 71.88 0.37 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.895 0.379 . . . . 0.0 111.603 179.729 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 684' ' ' ILE . . . . . 0.647 HD12 ' C ' ' A' ' 683' ' ' ARG . 2.1 mp -123.24 139.06 30.97 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.368 179.52 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 685' ' ' PRO . . . . . 0.507 ' HD2' HG23 ' A' ' 684' ' ' ILE . 33.0 Cg_endo -64.79 123.61 11.92 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.422 2.082 . . . . 0.0 112.454 -179.701 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 4.1 mmmt -69.92 -20.47 63.35 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.212 179.799 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 19.1 p -65.52 -23.86 66.98 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.555 -179.546 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 688' ' ' ALA . . . . . 0.458 ' HB3' ' HB3' ' A' ' 691' ' ' ARG . . . -69.14 110.77 4.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.756 0.312 . . . . 0.0 111.323 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -83.38 4.68 26.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.527 179.775 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -119.33 -17.79 8.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.904 0.383 . . . . 0.0 110.674 179.295 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 691' ' ' ARG . . . . . 0.641 ' CG ' HD22 ' A' ' 692' ' ' LEU . 8.3 ptt85 -49.81 -36.47 26.61 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.542 -179.715 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 692' ' ' LEU . . . . . 0.641 HD22 ' CG ' ' A' ' 691' ' ' ARG . 2.6 mm? -68.77 -52.64 28.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.623 -179.25 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.99 -39.65 69.1 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.838 0.352 . . . . 0.0 111.288 -179.731 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -61.86 -40.0 93.83 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.094 0.473 . . . . 0.0 110.15 179.558 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 695' ' ' LEU . . . . . 1.1 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 2.7 tp -65.57 -45.34 83.67 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.53 179.57 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 696' ' ' GLN . . . . . 0.464 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 9.8 mt-30 -55.43 -50.85 68.74 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.05 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -74.14 -29.67 61.92 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.01 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 698' ' ' ALA . . . . . 0.416 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.89 -39.29 83.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.602 -179.765 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 699' ' ' TYR . . . . . 0.517 ' CD2' ' CZ2' ' A' ' 675' ' ' TRP . 0.7 OUTLIER -86.0 -31.25 22.14 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.032 0.444 . . . . 0.0 110.485 179.84 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 700' ' ' CYS . . . . . 0.442 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 43.8 t -66.92 -30.52 70.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.852 179.89 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.14 -1.16 37.39 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.567 -179.719 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 702' ' ' TYR . . . . . 0.455 ' CD2' ' CD2' ' A' ' 633' ' ' LEU . 5.8 m-85 -119.06 -79.08 0.59 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.821 0.343 . . . . 0.0 111.326 -179.8 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 703' ' ' LEU . . . . . 0.627 ' CD2' HD12 ' A' ' 660' ' ' ILE . 3.8 tp -56.44 -43.06 79.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.571 -179.395 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 704' ' ' LEU . . . . . 0.442 ' HB2' ' O ' ' A' ' 700' ' ' CYS . 1.1 mm? -53.01 -37.17 61.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.893 0.378 . . . . 0.0 111.164 -179.771 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 3.9 m -65.63 -54.94 20.68 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.796 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 706' ' ' TYR . . . . . 0.625 ' O ' HD22 ' A' ' 709' ' ' LEU . 21.0 t80 -60.35 -29.19 68.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.738 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 4.8 p30 -96.91 -7.21 33.88 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -179.332 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 708' ' ' SER . . . . . 0.402 ' CB ' ' O ' ' A' ' 704' ' ' LEU . 41.8 m -102.89 -22.55 13.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.708 0.29 . . . . 0.0 111.363 -179.845 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 709' ' ' LEU . . . . . 0.658 HD23 ' O ' ' A' ' 709' ' ' LEU . 0.2 OUTLIER -71.43 170.97 12.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.772 0.32 . . . . 0.0 111.005 -179.941 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.63 166.75 41.38 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.168 -179.687 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 711' ' ' PRO . . . . . 0.421 ' O ' ' HB2' ' A' ' 714' ' ' HIS . 38.0 Cg_endo -66.53 -32.03 40.25 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.57 2.18 . . . . 0.0 112.045 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -48.86 -48.69 41.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.578 179.786 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 713' ' ' GLU . . . . . 0.437 ' HB2' ' CD1' ' A' ' 709' ' ' LEU . 6.2 mm-40 -59.71 -26.2 65.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.111 179.633 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 714' ' ' HIS . . . . . 0.429 ' HE1' ' O ' ' A' ' 706' ' ' TYR . 3.0 m80 -75.87 -54.05 7.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.387 179.665 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.77 -42.43 99.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.282 -179.657 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -66.37 -54.25 26.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.821 0.343 . . . . 0.0 111.16 -179.598 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 717' ' ' LEU . . . . . 0.539 ' O ' HG23 ' A' ' 721' ' ' VAL . 73.4 mt -63.64 -39.91 95.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.723 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 718' ' ' GLU . . . . . 0.605 ' HG3' HD13 ' A' ' 722' ' ' LEU . 23.4 tt0 -67.52 -54.32 21.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.302 179.825 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -50.72 -34.94 28.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.358 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 720' ' ' GLU . . . . . 0.434 ' O ' ' HG2' ' A' ' 723' ' ' MET . 2.9 mm-40 -70.51 -55.42 8.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.996 0.427 . . . . 0.0 110.723 179.842 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 721' ' ' VAL . . . . . 0.541 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 38.6 t -62.48 -54.87 28.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.112 -179.662 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 722' ' ' LEU . . . . . 0.656 HD11 ' CG ' ' A' ' 624' ' ' GLN . 3.6 mp -53.57 -40.04 65.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.872 -179.378 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 723' ' ' MET . . . . . 0.672 ' O ' HD12 ' A' ' 727' ' ' ILE . 9.5 ptp -74.59 -41.21 60.88 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 120.407 -0.517 . . . . 0.0 109.949 179.475 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 724' ' ' GLU . . . . . 0.409 ' N ' ' HG3' ' A' ' 723' ' ' MET . 4.2 mm-40 -55.61 -42.74 75.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.835 -179.414 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 725' ' ' LYS . . . . . 0.43 ' HB3' ' CZ3' ' A' ' 619' ' ' TRP . 0.0 OUTLIER -79.12 -36.66 40.27 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.661 -179.29 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -69.39 -53.27 20.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.837 0.351 . . . . 0.0 111.044 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 727' ' ' ILE . . . . . 0.672 HD12 ' O ' ' A' ' 723' ' ' MET . 3.7 mp -88.51 11.65 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.621 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 1.9 tt -53.98 -47.4 71.42 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.798 0.332 . . . . 0.0 111.121 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -73.21 -53.45 10.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.949 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 24.3 mtmt . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.896 179.968 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 619' ' ' TRP . . . . . 0.491 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.462 0.141 0 CA-C-O 120.56 0.219 . . . . 0.0 111.366 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 122.11 163.76 12.0 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.507 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -67.61 -40.76 9.59 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.597 2.198 . . . . 0.0 112.26 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 -62.27 -36.42 82.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.854 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 623' ' ' VAL . . . . . 0.481 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 43.0 t -75.77 -39.63 38.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.817 179.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 624' ' ' GLN . . . . . 0.523 ' CG ' HD11 ' A' ' 722' ' ' LEU . 3.8 tm0? -64.76 -40.53 95.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.669 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.24 -49.97 65.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.736 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 626' ' ' LEU . . . . . 0.619 ' O ' HD23 ' A' ' 626' ' ' LEU . 7.1 tt -63.48 -32.13 73.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.914 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -71.49 -50.16 34.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.317 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.21 -46.46 82.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.157 -179.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 30.3 mt -64.24 -40.85 90.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.056 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 7.4 ttpt -62.82 -47.24 84.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.999 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 1.3 tttm -59.1 -40.47 85.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.258 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 632' ' ' HIS . . . . . 0.892 ' CE1' HD21 ' A' ' 709' ' ' LEU . 82.6 t60 -72.78 -42.1 64.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.085 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.67 HD13 ' SD ' ' A' ' 640' ' ' MET . 20.2 mt -55.96 -49.85 72.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.355 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 634' ' ' ARG . . . . . 0.41 ' HA ' ' O ' ' A' ' 638' ' ' ILE . 1.0 OUTLIER -68.34 -39.48 81.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.847 179.988 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 1.3 m -73.68 -11.58 60.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.353 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -100.32 -4.62 28.83 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 111.733 0.271 . . . . 0.0 111.733 -179.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 113.23 -0.44 25.27 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.493 -0.86 . . . . 0.0 112.593 179.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 638' ' ' ILE . . . . . 0.41 ' O ' ' HA ' ' A' ' 634' ' ' ARG . 13.7 mt -108.63 104.68 17.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-O 120.666 0.27 . . . . 0.0 111.202 -179.421 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 1.6 m -77.42 116.8 18.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.876 0.369 . . . . 0.0 110.94 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 640' ' ' MET . . . . . 0.67 ' SD ' HD13 ' A' ' 633' ' ' LEU . 2.1 ttp -130.49 30.7 4.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.838 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -66.81 -39.31 87.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.01 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 642' ' ' GLU . . . . . 0.532 ' O ' HD12 ' A' ' 643' ' ' LEU . 6.6 mm-40 -63.57 -79.9 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.935 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 643' ' ' LEU . . . . . 0.532 HD12 ' O ' ' A' ' 642' ' ' GLU . 0.1 OUTLIER -178.37 132.34 0.3 Allowed Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.803 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 644' ' ' PRO . . . . . 0.548 ' HB2' HD11 ' A' ' 651' ' ' LEU . 74.4 Cg_endo -75.23 142.76 27.57 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.488 2.125 . . . . 0.0 112.266 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 645' ' ' LEU . . . . . 0.658 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.8 tp -133.84 151.93 51.7 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.211 0.529 . . . . 0.0 111.211 179.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 646' ' ' ILE . . . . . 0.742 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.1 tt -149.8 133.89 8.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.905 179.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.41 38.55 57.8 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.363 -0.922 . . . . 0.0 112.097 -179.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.2 7.88 64.17 Favored Glycine 0 CA--C 1.52 0.385 0 C-N-CA 120.94 -0.648 . . . . 0.0 113.584 179.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -132.67 162.55 31.1 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 117.311 0.556 . . . . 0.0 111.4 -179.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 650' ' ' GLU . . . . . 0.658 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.7 OUTLIER -77.78 145.21 36.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.793 179.888 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 651' ' ' LEU . . . . . 0.638 HD23 ' HD2' ' A' ' 656' ' ' PHE . 0.0 OUTLIER -135.22 145.37 47.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.373 -179.695 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -99.89 113.33 25.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.944 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -52.37 -39.44 60.79 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.127 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -63.69 -43.88 95.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.03 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 10.6 t -70.07 -38.31 75.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.746 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 656' ' ' PHE . . . . . 0.638 ' HD2' HD23 ' A' ' 651' ' ' LEU . 0.1 OUTLIER -68.7 -46.3 69.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.794 179.943 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 43.9 t80 -57.46 -48.79 78.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.893 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -60.66 -40.73 93.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.955 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . 0.453 HD11 ' CE ' ' A' ' 681' ' ' MET . 0.2 OUTLIER -57.95 -51.67 68.69 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.163 -179.752 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 660' ' ' ILE . . . . . 0.624 HG23 HG21 ' A' ' 669' ' ' VAL . 33.3 mt -56.75 -46.14 83.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 120.821 0.343 . . . . 0.0 111.127 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 23.6 t30 -61.43 -39.82 92.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.078 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -68.26 -13.85 62.56 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.51 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.46 36.61 1.24 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.797 0.332 . . . . 0.0 111.099 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 67.92 25.88 74.12 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.644 -0.788 . . . . 0.0 112.424 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 96.4 170.07 34.57 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.541 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 666' ' ' MET . . . . . 0.521 ' O ' HG22 ' A' ' 670' ' ' THR . 10.0 tpt -65.6 -37.74 87.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.727 0.298 . . . . 0.0 111.217 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 667' ' ' GLN . . . . . 0.432 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 4.9 pt20 -50.62 -43.69 56.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.449 -179.665 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 668' ' ' GLN . . . . . 0.419 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -66.96 -52.59 40.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.815 0.341 . . . . 0.0 110.973 -179.9 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 669' ' ' VAL . . . . . 0.624 HG21 HG23 ' A' ' 660' ' ' ILE . 55.4 t -49.19 -54.65 5.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.461 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 670' ' ' THR . . . . . 0.521 HG22 ' O ' ' A' ' 666' ' ' MET . 14.0 t -76.15 -52.51 9.94 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -178.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 671' ' ' ASP . . . . . 0.499 ' N ' HG23 ' A' ' 670' ' ' THR . 19.0 t70 -59.45 -51.15 71.12 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -177.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 672' ' ' LEU . . . . . 0.419 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 4.5 mm? -76.42 0.87 18.08 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 3.1 mtpm? 49.71 81.77 0.06 Allowed 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.017 0.437 . . . . 0.0 110.363 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 3.9 mttm -144.48 20.18 1.7 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.193 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 675' ' ' TRP . . . . . 1.147 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 26.0 m95 -55.75 -29.85 60.25 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.324 0.583 . . . . 0.0 110.236 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 -55.88 -41.7 74.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.843 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.69 -51.76 10.07 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.173 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 1.057 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -58.09 -40.51 81.32 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 179.691 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 679' ' ' ALA . . . . . 0.801 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -70.27 -36.13 74.22 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.554 179.184 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -53.36 -48.42 68.57 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.403 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 681' ' ' MET . . . . . 0.453 ' CE ' HD11 ' A' ' 659' ' ' LEU . 31.6 mtm -64.08 -23.07 67.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.844 179.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 682' ' ' LEU . . . . . 0.471 HD23 ' O ' ' A' ' 678' ' ' LEU . 3.4 mm? -78.21 -3.12 41.07 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.472 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . 0.695 ' C ' HD12 ' A' ' 684' ' ' ILE . 3.4 mtp85 70.4 71.74 0.21 Allowed 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.915 0.388 . . . . 0.0 111.592 179.6 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . 0.695 HD12 ' C ' ' A' ' 683' ' ' ARG . 2.2 mp -123.66 141.37 36.39 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.223 179.459 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . 0.651 ' HD2' HG23 ' A' ' 684' ' ' ILE . 44.2 Cg_endo -69.07 120.94 7.77 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.543 2.162 . . . . 0.0 112.752 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.01 -21.59 63.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.103 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.46 -22.33 66.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.601 -179.414 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 688' ' ' ALA . . . . . 0.74 ' HB3' ' HG2' ' A' ' 691' ' ' ARG . . . -72.24 116.24 12.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.929 0.395 . . . . 0.0 111.218 -179.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -83.44 4.9 25.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.396 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -121.88 -15.18 7.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.087 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 691' ' ' ARG . . . . . 0.809 ' HG3' HD22 ' A' ' 692' ' ' LEU . 0.5 OUTLIER -55.84 -32.8 63.92 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.088 -179.639 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . 0.809 HD22 ' HG3' ' A' ' 691' ' ' ARG . 3.3 mm? -70.58 -54.12 13.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.462 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.23 -37.66 72.0 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.417 -179.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 2.8 mmmt -64.28 -38.63 91.73 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.089 0.471 . . . . 0.0 109.896 179.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 1.147 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 4.3 tp -64.9 -47.12 78.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.812 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.404 ' HA ' ' CD2' ' A' ' 699' ' ' TYR . 24.8 mt-30 -55.21 -49.01 73.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.206 -179.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -76.02 -29.65 58.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.206 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 698' ' ' ALA . . . . . 0.406 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.26 -36.83 82.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.879 -179.585 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 699' ' ' TYR . . . . . 0.504 ' CE1' ' HE2' ' A' ' 666' ' ' MET . 1.5 p90 -85.63 -36.31 20.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.973 0.416 . . . . 0.0 110.495 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 700' ' ' CYS . . . . . . . . . . . . . 5.6 t -62.95 -30.59 71.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.538 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -96.77 -5.32 38.8 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.453 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 702' ' ' TYR . . . . . 0.411 ' CD2' HD21 ' A' ' 633' ' ' LEU . 6.1 m-85 -119.11 -78.21 0.58 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.851 0.358 . . . . 0.0 111.254 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 703' ' ' LEU . . . . . 0.474 HD13 ' HA ' ' A' ' 703' ' ' LEU . 3.9 mm? -55.34 -42.62 74.07 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.47 -179.506 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.456 HD23 ' CE1' ' A' ' 699' ' ' TYR . 1.1 mm? -61.64 -56.03 24.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.144 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.65 -55.27 31.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.961 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 706' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -59.59 -51.11 71.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.017 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -58.8 -20.57 51.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.282 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 1.4 m -84.29 -16.3 43.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.974 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 709' ' ' LEU . . . . . 0.892 HD21 ' CE1' ' A' ' 632' ' ' HIS . 62.3 mt -50.63 141.37 12.77 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.501 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 710' ' ' SER . . . . . 0.454 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.6 OUTLIER -75.92 168.25 29.5 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.597 179.742 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . 0.454 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 10.7 Cg_endo -54.13 -25.88 39.42 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.53 2.154 . . . . 0.0 112.376 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -69.98 -53.97 15.37 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.019 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 713' ' ' GLU . . . . . 0.519 ' HB2' ' HB3' ' A' ' 709' ' ' LEU . 62.1 mm-40 -59.73 -26.22 65.46 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.907 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 8.1 m-70 -75.89 -54.16 7.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.355 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.28 -41.77 99.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.344 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 2.8 mmm-85 -65.49 -54.2 31.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.858 0.361 . . . . 0.0 111.29 -179.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . 0.482 HD13 ' HB2' ' A' ' 632' ' ' HIS . 55.0 mt -65.44 -40.63 93.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.015 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 718' ' ' GLU . . . . . 0.74 ' HG2' HD22 ' A' ' 722' ' ' LEU . 30.8 tt0 -67.99 -54.32 19.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.639 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.98 -34.55 56.52 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.465 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 720' ' ' GLU . . . . . 0.43 ' O ' ' HG2' ' A' ' 723' ' ' MET . 0.4 OUTLIER -67.51 -55.9 11.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.021 0.438 . . . . 0.0 110.494 179.832 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 721' ' ' VAL . . . . . 0.491 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 33.3 t -64.06 -52.92 50.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.156 -179.637 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . 0.74 HD22 ' HG2' ' A' ' 718' ' ' GLU . 5.1 mp -49.03 -44.8 41.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.918 -179.397 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 723' ' ' MET . . . . . 0.527 ' HB2' HD13 ' A' ' 727' ' ' ILE . 18.8 ptp -72.19 -40.04 68.19 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.239 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 724' ' ' GLU . . . . . 0.409 ' N ' ' HG3' ' A' ' 723' ' ' MET . 5.5 mm-40 -52.64 -34.84 53.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.436 -179.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 725' ' ' LYS . . . . . 0.455 ' HD3' ' CE2' ' A' ' 619' ' ' TRP . 4.4 pttm -86.09 -40.29 15.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.455 -179.645 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -66.14 -52.59 46.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.383 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 727' ' ' ILE . . . . . 0.662 HG22 ' O ' ' A' ' 727' ' ' ILE . 4.6 mp -87.09 11.55 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.679 -179.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 728' ' ' LEU . . . . . 0.43 ' O ' HD23 ' A' ' 728' ' ' LEU . 4.9 tt -57.86 -32.57 67.78 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.881 0.372 . . . . 0.0 110.925 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -65.63 -68.8 0.34 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.927 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.874 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 619' ' ' TRP . . . . . 0.444 ' CE2' ' HD2' ' A' ' 725' ' ' LYS . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.145 0 CA-C-O 120.53 0.205 . . . . 0.0 111.369 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 119.78 159.04 10.79 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.47 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -66.99 -40.9 10.9 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.578 2.186 . . . . 0.0 112.013 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 622' ' ' ASN . . . . . 0.656 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 19.6 m-80 -64.61 -34.91 79.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.72 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 623' ' ' VAL . . . . . 0.417 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 38.6 t -72.98 -39.98 58.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.89 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 624' ' ' GLN . . . . . 0.567 ' CG ' HD11 ' A' ' 722' ' ' LEU . 3.1 tm0? -60.63 -41.18 94.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.709 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 6.6 mpt_? -67.0 -50.83 60.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.824 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 8.3 tt -62.01 -29.97 70.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.041 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 627' ' ' ALA . . . . . 0.411 ' HA ' ' HG2' ' A' ' 630' ' ' LYS . . . -70.98 -45.07 64.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.434 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -65.13 -38.85 91.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.262 -179.668 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 38.8 mt -66.8 -46.32 85.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.497 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 630' ' ' LYS . . . . . 0.456 ' HG3' ' N ' ' A' ' 631' ' ' LYS . 19.2 pttt -66.09 -32.6 74.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.798 0.332 . . . . 0.0 110.996 -179.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 631' ' ' LYS . . . . . 0.456 ' N ' ' HG3' ' A' ' 630' ' ' LYS . 0.0 OUTLIER -66.39 -44.76 82.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.991 0.424 . . . . 0.0 110.735 179.838 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 632' ' ' HIS . . . . . 0.847 ' CE1' HD21 ' A' ' 709' ' ' LEU . 86.2 t60 -71.3 -38.8 71.76 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.673 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.415 HD13 ' SD ' ' A' ' 640' ' ' MET . 47.6 mt -58.33 -49.8 75.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.016 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 634' ' ' ARG . . . . . 0.455 ' HG3' ' N ' ' A' ' 635' ' ' SER . 3.6 ptp180 -64.74 -40.32 95.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.866 0.365 . . . . 0.0 110.474 179.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 635' ' ' SER . . . . . 0.455 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 0.5 OUTLIER -73.86 -11.63 60.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.946 179.262 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 636' ' ' GLN . . . . . 0.409 ' HG3' ' NE2' ' A' ' 632' ' ' HIS . 33.4 mm-40 -98.6 -7.12 28.66 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.564 -179.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 114.05 -1.05 24.17 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.584 -0.817 . . . . 0.0 112.497 179.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 638' ' ' ILE . . . . . 0.409 HG21 ' CZ ' ' A' ' 702' ' ' TYR . 12.7 mt -108.11 104.77 17.61 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-O 120.635 0.255 . . . . 0.0 111.341 -179.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.6 121.19 21.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.825 0.345 . . . . 0.0 111.02 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 640' ' ' MET . . . . . 0.415 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.9 ttp -133.56 28.74 3.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.87 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -69.22 -30.71 68.94 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.913 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -71.61 -78.21 0.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.817 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 2.5 pp -179.93 128.37 0.24 Allowed Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.827 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 644' ' ' PRO . . . . . 0.543 ' HB2' HD11 ' A' ' 651' ' ' LEU . 64.6 Cg_endo -73.75 132.72 17.57 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.397 2.065 . . . . 0.0 112.289 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 645' ' ' LEU . . . . . 0.611 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.9 tp -123.67 151.73 42.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.192 0.52 . . . . 0.0 111.276 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 646' ' ' ILE . . . . . 0.81 HD11 ' HA ' ' A' ' 695' ' ' LEU . 0.7 OUTLIER -149.68 133.41 8.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.979 179.108 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 54.93 37.7 63.18 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.365 -0.922 . . . . 0.0 112.228 -179.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.89 7.66 66.64 Favored Glycine 0 C--N 1.332 0.335 0 C-N-CA 120.942 -0.647 . . . . 0.0 113.563 179.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.9 m -134.36 164.38 27.56 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 117.35 0.575 . . . . 0.0 111.417 -179.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 650' ' ' GLU . . . . . 0.611 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.3 OUTLIER -77.69 145.67 36.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.757 179.789 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 651' ' ' LEU . . . . . 0.615 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.93 145.15 47.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.384 -179.71 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -98.3 111.93 24.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.888 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -52.16 -35.74 49.53 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.056 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 654' ' ' ALA . . . . . 0.656 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -68.61 -44.93 73.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.115 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 10.7 t -67.99 -36.73 80.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.656 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 656' ' ' PHE . . . . . 0.581 ' HD2' HD23 ' A' ' 651' ' ' LEU . 0.1 OUTLIER -68.46 -44.47 74.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.826 179.908 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 56.6 t80 -58.69 -48.73 80.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.904 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 1.4 ttm180 -59.31 -43.03 92.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.99 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . 0.67 HD11 ' CE ' ' A' ' 681' ' ' MET . 0.2 OUTLIER -56.22 -49.71 73.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.145 -179.835 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 660' ' ' ILE . . . . . 0.604 HG23 HG21 ' A' ' 669' ' ' VAL . 16.9 mt -57.43 -44.71 85.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.821 0.343 . . . . 0.0 110.786 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -65.31 -47.52 76.28 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.271 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -55.5 -20.44 12.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.747 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.82 19.6 3.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.517 0.199 . . . . 0.0 111.508 -179.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 90.84 -18.19 51.73 Favored Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.562 -0.827 . . . . 0.0 112.725 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 665' ' ' GLY . . . . . 0.422 ' O ' HG23 ' A' ' 669' ' ' VAL . . . 147.37 175.34 20.12 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.369 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 666' ' ' MET . . . . . 0.507 ' O ' HG22 ' A' ' 670' ' ' THR . 0.0 OUTLIER -72.04 -36.69 69.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.898 0.38 . . . . 0.0 111.067 -179.928 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 667' ' ' GLN . . . . . 0.405 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 3.9 pt20 -56.08 -42.78 77.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.255 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 668' ' ' GLN . . . . . 0.549 ' HG3' HD11 ' A' ' 672' ' ' LEU . 0.0 OUTLIER -65.07 -45.14 86.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.956 0.408 . . . . 0.0 110.82 -179.988 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 669' ' ' VAL . . . . . 0.604 HG21 HG23 ' A' ' 660' ' ' ILE . 57.7 t -57.64 -55.71 19.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.564 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 670' ' ' THR . . . . . 0.507 HG22 ' O ' ' A' ' 666' ' ' MET . 9.7 t -76.04 -54.18 7.24 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.219 0.822 . . . . 0.0 113.219 -178.539 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 671' ' ' ASP . . . . . 0.507 ' N ' HG23 ' A' ' 670' ' ' THR . 7.1 t0 -56.21 -51.11 69.26 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -178.328 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 672' ' ' LEU . . . . . 0.549 HD11 ' HG3' ' A' ' 668' ' ' GLN . 28.0 mt -75.0 -1.81 24.36 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -179.117 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 11.3 mttp 50.46 84.15 0.04 OUTLIER 'General case' 0 CA--C 1.521 -0.151 0 CA-C-O 121.098 0.475 . . . . 0.0 110.371 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 5.6 tptm -148.73 21.63 1.01 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.138 -179.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 675' ' ' TRP . . . . . 1.114 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 27.5 m95 -56.26 -29.8 61.58 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 121.469 0.652 . . . . 0.0 109.996 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -56.45 -41.5 76.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.633 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.39 -51.75 10.29 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -179.309 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 1.02 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -57.32 -39.81 76.6 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.747 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 679' ' ' ALA . . . . . 0.822 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.56 -34.64 70.16 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.45 179.053 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -53.59 -47.78 69.82 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.267 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 681' ' ' MET . . . . . 0.67 ' CE ' HD11 ' A' ' 659' ' ' LEU . 0.0 OUTLIER -65.89 -21.55 66.46 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.779 179.306 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 682' ' ' LEU . . . . . 0.473 HD23 ' O ' ' A' ' 678' ' ' LEU . 3.1 mm? -78.28 -2.85 39.94 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.46 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . 0.691 ' C ' HD12 ' A' ' 684' ' ' ILE . 0.5 OUTLIER 71.66 71.79 0.17 Allowed 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.928 0.394 . . . . 0.0 111.251 179.842 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . 0.691 HD12 ' C ' ' A' ' 683' ' ' ARG . 2.1 mp -124.67 135.57 26.81 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.368 179.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -64.92 124.58 13.31 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.563 2.176 . . . . 0.0 112.506 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.79 -17.27 63.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.294 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.42 -24.0 67.09 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.702 0.287 . . . . 0.0 111.237 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 688' ' ' ALA . . . . . 0.423 ' HB3' ' HD3' ' A' ' 691' ' ' ARG . . . -79.31 112.28 16.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.921 0.391 . . . . 0.0 110.873 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -72.39 -68.35 0.48 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.329 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.44 -12.9 0.78 Allowed 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -179.153 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 691' ' ' ARG . . . . . 0.673 ' HG2' HD22 ' A' ' 692' ' ' LEU . 43.5 ptt85 -47.95 -42.79 28.41 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 120.919 0.39 . . . . 0.0 111.076 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . 0.673 HD22 ' HG2' ' A' ' 691' ' ' ARG . 2.5 mm? -60.99 -46.95 88.67 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.041 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.28 -39.0 68.67 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.886 0.375 . . . . 0.0 111.242 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 2.4 mttm -64.45 -38.73 92.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.246 179.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 1.114 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.9 OUTLIER -67.09 -44.23 80.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.488 179.756 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.443 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 4.2 mm-40 -55.43 -48.03 75.06 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.011 0.434 . . . . 0.0 110.816 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -76.82 -29.45 55.96 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.01 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 698' ' ' ALA . . . . . 0.433 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.35 -37.87 83.93 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.675 -179.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 699' ' ' TYR . . . . . 0.503 ' CZ ' ' HE3' ' A' ' 666' ' ' MET . 1.3 p90 -84.34 -35.08 23.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.892 0.377 . . . . 0.0 110.691 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 700' ' ' CYS . . . . . . . . . . . . . 28.8 t -64.86 -30.54 71.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.956 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -98.56 -2.41 38.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.581 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 702' ' ' TYR . . . . . 0.433 ' CD1' ' O ' ' A' ' 698' ' ' ALA . 4.8 m-85 -118.44 -78.83 0.59 Allowed 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.85 0.357 . . . . 0.0 111.343 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 90.9 mt -59.82 -40.86 89.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.636 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.424 HD23 ' CD1' ' A' ' 699' ' ' TYR . 0.8 OUTLIER -58.23 -55.34 36.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.92 0.39 . . . . 0.0 111.252 -179.682 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.57 -54.94 34.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.046 -179.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 706' ' ' TYR . . . . . 0.414 ' HA ' ' CD1' ' A' ' 709' ' ' LEU . 77.0 t80 -58.4 -50.32 74.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.206 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.78 -27.12 64.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.28 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 18.0 p -79.45 -16.88 55.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.178 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 709' ' ' LEU . . . . . 0.847 HD21 ' CE1' ' A' ' 632' ' ' HIS . 63.1 mt -53.37 147.34 10.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.935 0.398 . . . . 0.0 111.484 -179.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 710' ' ' SER . . . . . 0.454 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.4 OUTLIER -76.32 169.03 22.88 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.476 179.492 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . 0.454 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 15.9 Cg_endo -57.48 -21.61 46.58 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.473 2.115 . . . . 0.0 112.531 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 712' ' ' GLU . . . . . 0.419 ' O ' ' HG3' ' A' ' 715' ' ' ARG . 8.7 pt-20 -70.53 -53.6 15.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.056 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 713' ' ' GLU . . . . . 0.477 ' HB2' ' HB3' ' A' ' 709' ' ' LEU . 5.3 mm-40 -59.17 -26.05 64.44 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.521 -0.308 . . . . 0.0 111.125 -179.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 11.6 m-70 -75.91 -54.25 7.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.038 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 715' ' ' ARG . . . . . 0.419 ' HG3' ' O ' ' A' ' 712' ' ' GLU . 0.0 OUTLIER -64.1 -32.88 74.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.654 -179.243 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 7.9 mtt-85 -77.15 -54.22 6.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.926 0.393 . . . . 0.0 111.209 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . 0.494 ' O ' HG23 ' A' ' 721' ' ' VAL . 63.8 mt -62.74 -40.29 96.78 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.802 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 718' ' ' GLU . . . . . 0.722 ' HG2' HD22 ' A' ' 722' ' ' LEU . 16.8 tt0 -65.24 -54.59 27.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.637 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 719' ' ' LYS . . . . . 0.409 ' CG ' ' O ' ' A' ' 715' ' ' ARG . 0.7 OUTLIER -51.07 -36.76 41.76 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.425 -179.622 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 720' ' ' GLU . . . . . 0.417 ' O ' ' HG2' ' A' ' 723' ' ' MET . 2.3 mt-10 -67.36 -55.78 12.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.977 0.418 . . . . 0.0 110.653 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 721' ' ' VAL . . . . . 0.494 HG23 ' O ' ' A' ' 717' ' ' LEU . 39.5 t -61.92 -54.16 38.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.076 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . 0.722 HD22 ' HG2' ' A' ' 718' ' ' GLU . 4.6 mp -48.95 -45.67 42.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.858 -179.155 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 723' ' ' MET . . . . . 0.615 ' O ' HD12 ' A' ' 727' ' ' ILE . 15.7 ptp -73.11 -42.0 63.41 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 120.464 -0.495 . . . . 0.0 109.859 179.314 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 724' ' ' GLU . . . . . 0.4 ' N ' ' HG3' ' A' ' 723' ' ' MET . 2.2 mm-40 -54.23 -31.24 52.83 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.31 -179.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 725' ' ' LYS . . . . . 0.444 ' HD2' ' CE2' ' A' ' 619' ' ' TRP . 3.5 pttm -86.16 -36.61 19.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.335 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 726' ' ' GLU . . . . . 0.426 ' N ' ' HG3' ' A' ' 725' ' ' LYS . 4.9 mt-10 -71.65 -52.86 15.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.911 0.386 . . . . 0.0 111.124 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 727' ' ' ILE . . . . . 0.615 HD12 ' O ' ' A' ' 723' ' ' MET . 3.7 mp -87.63 11.66 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.68 -179.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.73 -48.96 79.39 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.745 0.307 . . . . 0.0 111.101 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -57.34 -32.46 66.75 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.1 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.197 -0.906 . . . . 0.0 110.884 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 619' ' ' TRP . . . . . 0.462 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.1 OUTLIER . . . . . 0 CA--C 1.528 0.131 0 CA-C-O 120.556 0.217 . . . . 0.0 111.565 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 122.42 157.9 10.09 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.42 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -68.84 -36.21 14.07 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.549 2.166 . . . . 0.0 112.025 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 54.9 m-80 -71.87 -30.91 65.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.696 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 623' ' ' VAL . . . . . 0.462 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 38.5 t -75.76 -37.49 35.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.617 179.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 624' ' ' GLN . . . . . 0.648 ' CG ' HD11 ' A' ' 722' ' ' LEU . 2.6 tm0? -66.39 -43.49 85.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.578 179.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 6.3 mmt85 -63.43 -50.45 69.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.567 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 626' ' ' LEU . . . . . 0.505 ' O ' HD23 ' A' ' 626' ' ' LEU . 2.8 tt -61.06 -35.17 76.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.74 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 627' ' ' ALA . . . . . 0.441 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -72.22 -46.06 57.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.204 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -58.39 -46.81 85.65 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.094 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 629' ' ' ILE . . . . . 0.424 HG21 HD23 ' A' ' 653' ' ' LEU . 31.2 mt -66.75 -37.71 80.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.09 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.11 -48.46 81.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.883 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 631' ' ' LYS . . . . . 0.45 ' HD2' HG22 ' A' ' 721' ' ' VAL . 0.8 OUTLIER -63.47 -40.5 97.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.009 -179.945 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 632' ' ' HIS . . . . . 0.621 ' HB2' HD13 ' A' ' 717' ' ' LEU . 67.8 t60 -66.51 -43.78 84.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.829 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.459 HD13 ' SD ' ' A' ' 640' ' ' MET . 49.7 mt -56.38 -49.92 73.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.175 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 634' ' ' ARG . . . . . 0.435 ' HG3' ' N ' ' A' ' 635' ' ' SER . 0.9 OUTLIER -60.82 -40.64 93.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.813 0.339 . . . . 0.0 110.717 179.914 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 635' ' ' SER . . . . . 0.435 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 49.1 m -73.74 -19.52 60.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.024 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -90.08 -10.46 44.65 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.586 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 119.07 -7.04 12.97 Favored Glycine 0 C--N 1.331 0.298 0 C-N-CA 120.613 -0.804 . . . . 0.0 112.524 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 638' ' ' ILE . . . . . 0.653 ' N ' HD12 ' A' ' 638' ' ' ILE . 3.6 mp -101.18 104.62 16.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.669 0.271 . . . . 0.0 111.143 -179.662 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 1.6 m -78.34 108.14 11.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.895 0.379 . . . . 0.0 110.869 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 640' ' ' MET . . . . . 0.459 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.9 mtp -122.33 28.61 7.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.98 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -61.0 -31.38 70.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.853 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 51.8 mm-40 -72.39 -78.23 0.09 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.865 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 1.1 pp -177.37 138.54 0.42 Allowed Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.888 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 644' ' ' PRO . . . . . 0.448 ' HB2' HD11 ' A' ' 651' ' ' LEU . 74.2 Cg_endo -75.65 136.92 19.71 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.562 2.175 . . . . 0.0 112.379 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 645' ' ' LEU . . . . . 0.659 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.6 tp -133.75 150.95 51.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.245 0.545 . . . . 0.0 111.267 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 646' ' ' ILE . . . . . 0.61 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.4 tt -149.82 133.93 8.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.702 178.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.15 39.95 58.77 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.319 -0.943 . . . . 0.0 112.429 -179.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.03 7.14 61.86 Favored Glycine 0 C--N 1.333 0.381 0 C-N-CA 120.904 -0.665 . . . . 0.0 113.799 179.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -133.57 164.26 27.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 117.396 0.598 . . . . 0.0 111.374 -179.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 650' ' ' GLU . . . . . 0.659 ' HA ' HD12 ' A' ' 645' ' ' LEU . 3.2 mt-10 -79.33 144.35 34.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.748 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 651' ' ' LEU . . . . . 0.624 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.59 144.99 48.25 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.306 -179.745 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 652' ' ' ASP . . . . . 0.493 ' OD1' ' HB3' ' A' ' 654' ' ' ALA . 10.9 t0 -94.81 105.09 17.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.932 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 653' ' ' LEU . . . . . 0.424 HD23 HG21 ' A' ' 629' ' ' ILE . 5.6 mp -53.88 -38.69 65.02 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.975 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 654' ' ' ALA . . . . . 0.493 ' HB3' ' OD1' ' A' ' 652' ' ' ASP . . . -63.57 -43.16 97.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.982 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 1.7 t -69.82 -31.66 69.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.465 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 656' ' ' PHE . . . . . 0.534 ' HD2' HD23 ' A' ' 651' ' ' LEU . 0.1 OUTLIER -72.42 -44.66 62.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.827 179.789 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -59.75 -48.47 81.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.843 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.75 -43.3 99.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.112 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . 0.688 HD13 ' CD2' ' A' ' 682' ' ' LEU . 0.3 OUTLIER -59.57 -49.38 78.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.404 -179.648 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 660' ' ' ILE . . . . . 0.79 HG23 HG21 ' A' ' 669' ' ' VAL . 85.6 mt -56.75 -45.64 82.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.793 0.33 . . . . 0.0 110.993 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.76 -44.23 86.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.109 -179.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -64.16 -32.47 74.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.159 -179.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . 0.467 ' CE ' HG22 ' A' ' 669' ' ' VAL . 1.2 mtm -72.73 -9.6 58.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.479 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 119.27 38.38 0.74 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.339 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 75.93 173.16 34.54 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.718 -0.754 . . . . 0.0 112.428 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 666' ' ' MET . . . . . 0.556 ' O ' HG22 ' A' ' 670' ' ' THR . 10.5 tpt -66.45 -41.67 88.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.682 0.277 . . . . 0.0 111.366 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 667' ' ' GLN . . . . . 0.427 ' O ' ' HB2' ' A' ' 671' ' ' ASP . 5.6 pt20 -50.37 -46.66 56.1 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -179.157 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 668' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -50.78 69.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.887 0.375 . . . . 0.0 111.059 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 669' ' ' VAL . . . . . 0.79 HG21 HG23 ' A' ' 660' ' ' ILE . 48.9 t -55.74 -55.5 17.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.911 -179.748 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 670' ' ' THR . . . . . 0.587 HG23 ' OD1' ' A' ' 671' ' ' ASP . 15.2 t -75.95 -52.45 10.25 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -178.007 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 671' ' ' ASP . . . . . 0.587 ' OD1' HG23 ' A' ' 670' ' ' THR . 0.8 OUTLIER -60.79 -50.97 71.33 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -178.203 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 26.3 mt -76.39 1.61 15.84 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 2.3 mttm 49.86 82.96 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.021 0.439 . . . . 0.0 110.266 -179.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 1.4 ttmp? -142.73 23.73 1.91 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.304 -179.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 675' ' ' TRP . . . . . 1.113 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 37.8 m95 -62.4 -27.64 69.23 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.337 0.589 . . . . 0.0 110.211 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -57.67 -45.48 85.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.482 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.01 -51.61 13.17 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.742 0.306 . . . . 0.0 111.445 -179.382 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.981 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -56.01 -40.55 73.55 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 179.624 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 679' ' ' ALA . . . . . 0.83 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.71 -31.87 67.2 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.496 179.18 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.18 -49.69 71.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.194 179.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 681' ' ' MET . . . . . 0.534 ' CE ' HD11 ' A' ' 659' ' ' LEU . 1.9 ttm -62.38 -21.44 65.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.603 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 682' ' ' LEU . . . . . 0.688 ' CD2' HD13 ' A' ' 659' ' ' LEU . 3.4 mm? -80.55 -1.51 42.28 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.371 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . 0.64 ' C ' HD12 ' A' ' 684' ' ' ILE . 10.3 mmm180 68.84 71.77 0.28 Allowed 'General case' 0 N--CA 1.462 0.126 0 CA-C-O 120.936 0.398 . . . . 0.0 110.861 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . 0.64 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.7 mp -118.78 136.48 24.23 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.926 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.52 123.68 11.43 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.486 2.124 . . . . 0.0 112.272 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -16.85 63.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.387 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.29 -23.79 67.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.01 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 688' ' ' ALA . . . . . 0.495 ' HB1' ' HB2' ' A' ' 691' ' ' ARG . . . -84.51 106.08 15.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.846 0.355 . . . . 0.0 110.95 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -73.17 -68.56 0.48 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.325 -179.576 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -51.97 -19.76 2.0 Allowed 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -179.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 691' ' ' ARG . . . . . 0.495 ' HB2' ' HB1' ' A' ' 688' ' ' ALA . 0.0 OUTLIER -46.2 -39.43 9.74 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.789 0.328 . . . . 0.0 111.223 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -58.61 -45.35 89.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.844 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.11 -37.51 69.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.99 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.8 -40.85 97.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.224 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 1.113 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.3 OUTLIER -65.44 -44.31 87.71 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.18 179.499 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.431 ' O ' ' CD2' ' A' ' 699' ' ' TYR . 42.9 tt0 -55.76 -45.88 77.98 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.884 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.25 -29.89 54.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.041 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 698' ' ' ALA . . . . . 0.449 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -66.42 -37.58 85.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.483 -179.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 699' ' ' TYR . . . . . 0.527 ' CZ ' ' HE2' ' A' ' 666' ' ' MET . 1.7 p90 -86.04 -33.92 20.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.074 0.464 . . . . 0.0 110.233 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 700' ' ' CYS . . . . . 0.543 ' HA ' HD23 ' A' ' 704' ' ' LEU . 1.4 m -63.1 -30.53 71.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.867 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -100.97 -1.81 33.44 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.478 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 702' ' ' TYR . . . . . 0.554 ' CE2' HG21 ' A' ' 638' ' ' ILE . 4.5 m-85 -117.57 -75.94 0.58 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.94 0.4 . . . . 0.0 111.4 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 20.2 mt -64.27 -41.73 96.78 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.812 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.543 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.4 OUTLIER -47.92 -56.91 6.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.848 0.356 . . . . 0.0 111.431 -179.496 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 1.4 m -54.64 -46.44 73.93 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.27 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 706' ' ' TYR . . . . . 0.608 ' O ' HD22 ' A' ' 709' ' ' LEU . 67.7 t80 -63.43 -29.47 70.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.346 -179.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -96.92 -2.47 43.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.709 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 57.8 m -113.2 -21.57 10.93 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.727 0.298 . . . . 0.0 111.36 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 709' ' ' LEU . . . . . 0.664 ' O ' HD23 ' A' ' 709' ' ' LEU . 0.2 OUTLIER -69.56 171.54 8.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.885 179.981 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -72.66 164.29 61.36 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.008 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.26 -29.88 54.81 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.544 2.163 . . . . 0.0 111.959 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -51.07 -50.81 57.97 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.75 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 713' ' ' GLU . . . . . 0.453 ' HB2' ' CD1' ' A' ' 709' ' ' LEU . 1.6 mm-40 -58.26 -28.21 64.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.935 179.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 714' ' ' HIS . . . . . 0.535 ' CD2' HD21 ' A' ' 709' ' ' LEU . 1.7 m170 -76.02 -54.01 7.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.583 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.68 -44.64 96.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.37 -179.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 2.0 mtp-105 -65.66 -54.16 31.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.273 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . 0.621 HD13 ' HB2' ' A' ' 632' ' ' HIS . 76.8 mt -62.98 -41.13 99.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.787 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 718' ' ' GLU . . . . . 0.65 ' HG3' HD13 ' A' ' 722' ' ' LEU . 30.3 tt0 -66.82 -54.12 25.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.3 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.74 -34.62 27.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.347 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 720' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' A' ' 723' ' ' MET . 6.0 mt-10 -68.54 -55.63 11.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.009 0.433 . . . . 0.0 110.428 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 721' ' ' VAL . . . . . 0.45 HG22 ' HD2' ' A' ' 631' ' ' LYS . 44.7 t -61.55 -53.66 45.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.808 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . 0.65 HD13 ' HG3' ' A' ' 718' ' ' GLU . 3.6 mp -48.69 -46.43 40.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.884 -179.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 723' ' ' MET . . . . . 0.564 ' HB2' HD13 ' A' ' 727' ' ' ILE . 16.5 ptp -71.49 -41.01 69.85 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.566 -0.454 . . . . 0.0 109.873 179.399 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 724' ' ' GLU . . . . . 0.417 ' N ' ' HG3' ' A' ' 723' ' ' MET . 1.9 mm-40 -53.48 -32.8 51.79 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.403 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 725' ' ' LYS . . . . . 0.456 ' HD3' ' CE2' ' A' ' 619' ' ' TRP . 8.7 pttt -86.18 -41.92 14.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.314 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 726' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 722' ' ' LEU . 13.7 mt-10 -66.23 -54.0 30.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.882 0.373 . . . . 0.0 111.147 -179.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 727' ' ' ILE . . . . . 0.631 HG22 ' O ' ' A' ' 727' ' ' ILE . 4.3 mp -86.94 11.51 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.746 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 1.7 tt -57.65 -42.15 82.88 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.817 0.342 . . . . 0.0 111.168 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -59.62 -51.06 71.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.123 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 730' ' ' LYS . . . . . 0.49 ' HD3' HG23 ' A' ' 727' ' ' ILE . 9.4 mtpt . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.861 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 619' ' ' TRP . . . . . 0.535 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.131 0 CA-C-O 120.645 0.259 . . . . 0.0 111.29 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 120.57 169.14 13.84 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.489 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -68.15 -38.71 11.8 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.59 2.193 . . . . 0.0 112.174 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 622' ' ' ASN . . . . . 0.533 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 59.5 m-80 -62.46 -42.64 99.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.93 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 623' ' ' VAL . . . . . 0.464 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 40.5 t -72.15 -35.01 51.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.845 179.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 624' ' ' GLN . . . . . 0.603 ' CG ' HD11 ' A' ' 722' ' ' LEU . 2.1 tm0? -57.7 -47.32 82.69 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.766 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.69 -43.5 75.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.796 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 626' ' ' LEU . . . . . 0.545 ' O ' HD23 ' A' ' 626' ' ' LEU . 6.2 tt -59.7 -36.93 77.51 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.971 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 627' ' ' ALA . . . . . 0.455 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -72.77 -46.29 54.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.293 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.17 -46.82 82.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.054 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 23.5 mt -66.63 -40.04 85.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.122 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 6.1 ttpt -62.9 -49.41 74.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.905 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 631' ' ' LYS . . . . . 0.478 ' HD2' HG22 ' A' ' 721' ' ' VAL . 2.7 tttm -58.13 -42.57 86.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.036 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 632' ' ' HIS . . . . . 0.74 ' HB2' HD13 ' A' ' 717' ' ' LEU . 79.9 t60 -68.27 -41.92 80.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.974 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.592 HD13 ' SD ' ' A' ' 640' ' ' MET . 39.1 mt -56.04 -47.41 77.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.21 -179.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 1.7 ptt180 -65.43 -41.75 93.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.77 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.78 -13.57 60.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.304 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 636' ' ' GLN . . . . . 0.45 ' CG ' ' CE1' ' A' ' 632' ' ' HIS . 62.4 mm-40 -96.21 -9.46 30.41 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.619 -179.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 118.89 -9.86 12.3 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.595 -0.812 . . . . 0.0 112.371 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 638' ' ' ILE . . . . . 0.638 ' N ' HD12 ' A' ' 638' ' ' ILE . 3.5 mp -98.79 104.75 16.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.708 0.29 . . . . 0.0 111.074 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -80.61 116.08 20.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.963 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 640' ' ' MET . . . . . 0.592 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.5 ttp -124.26 16.66 9.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.182 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.79 -31.21 62.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.839 0.352 . . . . 0.0 111.036 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -70.91 -73.67 0.17 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.786 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 1.9 pp -179.73 130.77 0.25 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.749 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.11 124.79 9.81 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.432 2.088 . . . . 0.0 112.287 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 645' ' ' LEU . . . . . 0.644 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.8 tp -127.36 152.76 47.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.28 0.562 . . . . 0.0 111.323 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 646' ' ' ILE . . . . . 0.483 HG22 ' HB3' ' A' ' 651' ' ' LEU . 4.4 tt -149.65 133.42 8.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.486 178.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 50.71 43.01 46.46 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.25 -0.976 . . . . 0.0 112.212 -179.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 68.86 6.77 53.44 Favored Glycine 0 CA--C 1.52 0.39 0 C-N-CA 121.068 -0.587 . . . . 0.0 113.908 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 62.4 m -130.9 161.97 30.69 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 117.609 0.705 . . . . 0.0 111.636 -179.072 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 650' ' ' GLU . . . . . 0.644 ' HA ' HD12 ' A' ' 645' ' ' LEU . 10.3 mt-10 -80.41 142.57 34.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.759 179.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 651' ' ' LEU . . . . . 0.638 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -135.16 145.3 47.64 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.298 -179.742 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -96.36 111.64 23.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.787 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -51.97 -38.94 58.41 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.029 -179.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 654' ' ' ALA . . . . . 0.533 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -65.04 -44.35 89.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.055 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -68.55 -33.9 74.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.862 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 656' ' ' PHE . . . . . 0.432 ' CE2' ' HG ' ' A' ' 682' ' ' LEU . 0.7 OUTLIER -72.88 -45.16 59.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.853 -179.96 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -61.39 -46.48 89.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.725 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.96 -45.32 95.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.816 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . 0.622 HD12 ' HB2' ' A' ' 678' ' ' LEU . 0.2 OUTLIER -56.62 -48.76 76.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.933 -179.975 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 660' ' ' ILE . . . . . 0.746 HG21 ' HG2' ' A' ' 666' ' ' MET . 76.9 mt -58.2 -45.48 88.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.927 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 14.4 m-20 -64.74 -46.54 81.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.231 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.38 -40.71 71.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.179 -179.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . 0.401 ' HE1' ' N ' ' A' ' 678' ' ' LEU . 0.0 OUTLIER -65.95 -27.22 68.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.028 -179.983 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 131.69 46.98 0.12 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.347 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 75.99 176.45 40.81 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.505 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 666' ' ' MET . . . . . 0.746 ' HG2' HG21 ' A' ' 660' ' ' ILE . 0.0 OUTLIER -73.11 -30.58 63.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.768 0.318 . . . . 0.0 111.109 -179.975 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 667' ' ' GLN . . . . . 0.423 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 4.3 pt20 -57.25 -45.77 83.67 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.641 -179.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 668' ' ' GLN . . . . . 0.466 ' HA ' HD13 ' A' ' 672' ' ' LEU . 0.0 OUTLIER -66.5 -52.76 42.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.838 0.351 . . . . 0.0 111.336 -179.615 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 669' ' ' VAL . . . . . 0.728 HG21 HG23 ' A' ' 660' ' ' ILE . 66.8 t -49.51 -54.97 5.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.572 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 670' ' ' THR . . . . . 0.613 HG22 ' O ' ' A' ' 666' ' ' MET . 12.3 t -76.18 -49.59 16.8 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 -178.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 671' ' ' ASP . . . . . 0.471 ' N ' HG23 ' A' ' 670' ' ' THR . 7.9 t70 -62.95 -51.16 67.96 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -177.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 672' ' ' LEU . . . . . 0.466 HD13 ' HA ' ' A' ' 668' ' ' GLN . 10.7 mp -79.04 3.6 16.85 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -179.04 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 14.7 ttmm 48.56 84.81 0.03 OUTLIER 'General case' 0 C--O 1.231 0.13 0 CA-C-O 120.971 0.415 . . . . 0.0 110.507 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt -145.06 22.9 1.54 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.24 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 675' ' ' TRP . . . . . 1.087 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 39.4 m95 -61.24 -28.63 69.3 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 121.397 0.617 . . . . 0.0 110.112 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 -56.9 -43.9 81.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.484 -179.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.14 -51.52 12.0 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.755 0.312 . . . . 0.0 111.44 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.969 HD22 ' HA ' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.59 -40.39 71.98 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 179.645 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 679' ' ' ALA . . . . . 0.835 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.83 -33.61 68.62 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.513 179.074 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.33 -49.5 66.96 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.211 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 19.9 mtm -62.92 -22.62 66.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.67 179.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 682' ' ' LEU . . . . . 0.477 HD23 ' O ' ' A' ' 678' ' ' LEU . 3.5 mm? -79.53 -1.23 36.74 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.333 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . 0.667 ' C ' HD12 ' A' ' 684' ' ' ILE . 0.2 OUTLIER 69.38 71.81 0.25 Allowed 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 120.951 0.405 . . . . 0.0 111.065 -179.83 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . 0.667 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.7 mp -119.81 135.7 24.39 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.72 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.99 123.16 10.9 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.411 2.074 . . . . 0.0 112.375 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -16.4 63.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.167 179.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.46 -23.74 66.99 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.12 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 688' ' ' ALA . . . . . 0.422 ' CB ' ' HB2' ' A' ' 691' ' ' ARG . . . -85.25 105.36 15.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.834 0.349 . . . . 0.0 111.011 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 -70.32 -68.35 0.43 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.141 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -53.33 -17.8 2.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.909 -179.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 691' ' ' ARG . . . . . 0.61 ' NE ' HG23 ' A' ' 684' ' ' ILE . 0.0 OUTLIER -46.82 -35.25 6.08 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.905 0.383 . . . . 0.0 111.143 179.904 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . 0.413 HD13 ' HA ' ' A' ' 692' ' ' LEU . 3.8 mm? -66.28 -40.74 90.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.869 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.11 -37.65 69.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.889 179.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 20.9 mmtt -64.3 -40.66 96.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.173 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 1.087 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.8 OUTLIER -64.83 -44.55 89.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.377 179.545 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.445 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 3.1 mt-30 -55.42 -46.3 76.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.815 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.08 -29.63 55.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.132 179.888 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -67.49 -38.53 84.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.581 -179.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 699' ' ' TYR . . . . . 0.779 ' HB2' HD12 ' A' ' 703' ' ' LEU . 1.1 p90 -85.69 -31.82 22.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.948 0.404 . . . . 0.0 110.516 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 700' ' ' CYS . . . . . 0.43 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 1.6 m -65.77 -30.61 71.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.476 179.509 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -97.11 -8.47 30.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.37 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 702' ' ' TYR . . . . . 0.419 ' CE2' HG21 ' A' ' 638' ' ' ILE . 4.0 m-85 -113.47 -78.99 0.58 Allowed 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.829 0.347 . . . . 0.0 111.367 -179.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 703' ' ' LEU . . . . . 0.779 HD12 ' HB2' ' A' ' 699' ' ' TYR . 61.6 mt -56.17 -46.55 79.31 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.618 -179.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.452 HD23 ' CE1' ' A' ' 699' ' ' TYR . 1.0 OUTLIER -53.97 -48.62 70.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.901 0.382 . . . . 0.0 110.887 -179.928 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . 0.638 ' O ' HD13 ' A' ' 709' ' ' LEU . 4.4 m -54.63 -54.97 34.54 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.347 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 706' ' ' TYR . . . . . 0.497 ' CE2' ' CE1' ' A' ' 714' ' ' HIS . 18.4 t80 -46.81 -43.59 18.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.787 -179.678 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -94.49 1.61 55.73 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 29.7 t -80.56 -20.29 43.74 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 709' ' ' LEU . . . . . 0.638 HD13 ' O ' ' A' ' 705' ' ' SER . 0.0 OUTLIER -94.62 -174.27 3.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.824 0.345 . . . . 0.0 111.46 -179.768 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 710' ' ' SER . . . . . 0.416 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.4 OUTLIER -85.3 167.06 27.54 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.965 -179.817 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . 0.416 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 18.8 Cg_endo -58.92 -17.86 39.44 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.608 2.205 . . . . 0.0 112.765 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -60.12 -52.75 64.02 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.8 0.333 . . . . 0.0 110.889 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 713' ' ' GLU . . . . . 0.436 ' O ' HD12 ' A' ' 717' ' ' LEU . 65.9 mm-40 -64.47 -25.88 68.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.955 179.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 714' ' ' HIS . . . . . 0.497 ' CE1' ' CE2' ' A' ' 706' ' ' TYR . 0.1 OUTLIER -74.91 -54.63 6.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.171 179.599 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 15.5 mmm180 -65.25 -36.21 83.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.274 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 18.6 mtt180 -65.52 -54.23 31.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.822 0.344 . . . . 0.0 110.993 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . 0.74 HD13 ' HB2' ' A' ' 632' ' ' HIS . 30.5 mt -62.77 -34.84 78.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.694 179.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 718' ' ' GLU . . . . . 0.703 ' HG2' HD22 ' A' ' 722' ' ' LEU . 27.0 tt0 -69.39 -53.9 17.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.394 179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -52.34 -34.09 45.72 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.432 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 720' ' ' GLU . . . . . 0.449 ' O ' ' HG2' ' A' ' 723' ' ' MET . 1.0 OUTLIER -69.35 -55.81 9.33 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.019 0.437 . . . . 0.0 110.389 179.775 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 721' ' ' VAL . . . . . 0.617 HG23 ' O ' ' A' ' 717' ' ' LEU . 21.5 t -61.8 -53.13 52.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.053 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . 0.703 HD22 ' HG2' ' A' ' 718' ' ' GLU . 6.9 mp -51.81 -42.49 62.54 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.009 -179.271 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 723' ' ' MET . . . . . 0.605 ' O ' HD12 ' A' ' 727' ' ' ILE . 14.2 ptp -71.91 -39.71 69.32 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.487 -0.485 . . . . 0.0 109.994 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 724' ' ' GLU . . . . . 0.416 ' N ' ' HG3' ' A' ' 723' ' ' MET . 1.4 mt-10 -56.29 -32.0 64.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.291 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 725' ' ' LYS . . . . . 0.457 ' HD3' ' CE2' ' A' ' 619' ' ' TRP . 7.5 pttt -86.15 -43.84 12.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.298 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -63.96 -48.43 76.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.922 0.392 . . . . 0.0 110.982 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 727' ' ' ILE . . . . . 0.654 HG22 ' O ' ' A' ' 727' ' ' ILE . 4.3 mp -89.46 11.57 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.526 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 1.5 tt -57.69 -34.52 69.51 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.794 0.33 . . . . 0.0 110.959 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -76.88 -53.08 8.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.953 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 3.1 mttt . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.935 179.979 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 619' ' ' TRP . . . . . 0.435 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.5 OUTLIER . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.777 0.322 . . . . 0.0 110.813 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . -55.99 170.58 2.22 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.468 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.76 -49.42 2.28 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.509 2.139 . . . . 0.0 112.09 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 622' ' ' ASN . . . . . 0.584 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 0.1 OUTLIER -58.61 -20.64 49.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.288 -179.938 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 623' ' ' VAL . . . . . 0.435 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 28.9 t -75.7 -45.93 37.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.911 0.386 . . . . 0.0 110.472 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.08 -43.81 94.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.163 179.341 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.06 -50.86 71.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.537 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 7.4 tt -62.54 -33.27 74.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.949 0.404 . . . . 0.0 110.542 179.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 627' ' ' ALA . . . . . 0.573 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -69.46 -46.83 65.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.267 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -62.28 -44.64 96.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.128 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 629' ' ' ILE . . . . . 0.467 ' HA ' ' CD2' ' A' ' 632' ' ' HIS . 14.6 mt -60.54 -45.08 97.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.99 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 630' ' ' LYS . . . . . 0.482 ' HA ' HD12 ' A' ' 633' ' ' LEU . 13.8 ttpt -64.13 -34.32 77.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.231 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.36 -48.03 74.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.641 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 632' ' ' HIS . . . . . 0.468 ' HB3' HD13 ' A' ' 717' ' ' LEU . 1.1 p80 -68.53 -37.83 80.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.823 0.344 . . . . 0.0 110.558 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.489 HD13 ' SD ' ' A' ' 640' ' ' MET . 32.1 mt -55.73 -49.95 71.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.121 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 634' ' ' ARG . . . . . 0.408 ' HG3' ' N ' ' A' ' 635' ' ' SER . 4.1 ptt180 -65.25 -40.99 94.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.78 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 635' ' ' SER . . . . . 0.408 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 1.4 m -73.75 -13.33 60.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.408 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 636' ' ' GLN . . . . . 0.587 HE22 HD21 ' A' ' 709' ' ' LEU . 0.0 OUTLIER -97.39 -6.56 33.79 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.661 -179.654 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 111.96 4.21 26.11 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.6 -0.809 . . . . 0.0 112.57 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 638' ' ' ILE . . . . . . . . . . . . . 17.7 mt -110.77 106.09 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-O 120.72 0.295 . . . . 0.0 111.238 -179.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.2 118.4 24.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.892 0.377 . . . . 0.0 110.816 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 640' ' ' MET . . . . . 0.489 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.5 ttp -121.45 23.01 10.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.174 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -58.08 -30.61 66.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.011 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -71.23 -79.49 0.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.853 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -178.36 133.82 0.31 Allowed Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.839 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -77.79 118.24 4.44 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.582 2.188 . . . . 0.0 112.388 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 645' ' ' LEU . . . . . 0.636 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.9 tp -118.58 152.55 35.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.226 0.536 . . . . 0.0 111.181 179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 646' ' ' ILE . . . . . 0.661 HD11 ' HA ' ' A' ' 695' ' ' LEU . 15.8 tt -149.67 133.88 8.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.828 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 52.28 40.24 52.59 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.363 -0.922 . . . . 0.0 112.239 -179.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.33 8.0 61.49 Favored Glycine 0 C--N 1.333 0.382 0 C-N-CA 120.913 -0.66 . . . . 0.0 113.686 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.2 m -133.51 163.3 29.68 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 117.366 0.583 . . . . 0.0 111.368 -179.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 650' ' ' GLU . . . . . 0.636 ' HA ' HD12 ' A' ' 645' ' ' LEU . 5.0 mt-10 -79.84 144.67 33.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.657 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 651' ' ' LEU . . . . . 0.615 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.62 145.07 48.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.352 -179.783 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -97.08 109.76 22.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.841 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 653' ' ' LEU . . . . . 0.561 HD12 ' CD2' ' A' ' 651' ' ' LEU . 5.7 mp -52.14 -37.84 55.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.004 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 654' ' ' ALA . . . . . 0.584 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -66.05 -44.05 85.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.174 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 5.7 t -69.9 -36.45 75.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.67 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 656' ' ' PHE . . . . . 0.435 ' CZ ' ' HG ' ' A' ' 682' ' ' LEU . 0.2 OUTLIER -70.93 -45.85 63.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.831 179.998 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -57.73 -50.57 72.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.993 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.87 -41.17 95.41 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.989 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . 0.843 HD22 HD23 ' A' ' 682' ' ' LEU . 0.1 OUTLIER -59.0 -49.85 76.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.111 -179.794 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 660' ' ' ILE . . . . . 0.783 HG23 HG21 ' A' ' 669' ' ' VAL . 62.8 mt -56.87 -46.14 83.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.767 0.318 . . . . 0.0 110.882 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -61.81 -38.08 86.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.016 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 51.6 tt0 -66.69 -14.73 62.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.422 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.16 33.59 1.72 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.824 0.345 . . . . 0.0 111.101 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 72.46 25.16 74.94 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.641 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 97.48 169.61 32.93 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.583 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 666' ' ' MET . . . . . 0.507 ' HE2' ' CE1' ' A' ' 699' ' ' TYR . 9.6 tpt -64.82 -37.47 87.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.703 0.287 . . . . 0.0 111.116 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 667' ' ' GLN . . . . . 0.448 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 8.3 pt20 -50.79 -44.13 58.76 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.308 -179.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 668' ' ' GLN . . . . . 0.472 ' HA ' HD13 ' A' ' 672' ' ' LEU . 0.0 OUTLIER -65.85 -52.74 47.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.903 0.382 . . . . 0.0 110.922 179.959 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 669' ' ' VAL . . . . . 0.783 HG21 HG23 ' A' ' 660' ' ' ILE . 48.4 t -49.57 -55.83 4.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.687 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 670' ' ' THR . . . . . 0.511 HG23 ' N ' ' A' ' 671' ' ' ASP . 14.0 t -76.27 -53.67 7.9 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.658 0.984 . . . . 0.0 113.658 -178.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 671' ' ' ASP . . . . . 0.511 ' N ' HG23 ' A' ' 670' ' ' THR . 6.3 t70 -58.56 -51.17 71.03 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -177.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 672' ' ' LEU . . . . . 0.472 HD13 ' HA ' ' A' ' 668' ' ' GLN . 9.1 mp -77.22 1.84 17.27 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -178.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 49.07 83.43 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.13 0.49 . . . . 0.0 110.532 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.18 22.7 1.36 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.646 -0.707 . . . . 0.0 110.981 -179.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 675' ' ' TRP . . . . . 1.121 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 29.3 m95 -58.47 -28.63 65.51 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 121.391 0.615 . . . . 0.0 110.204 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 14.8 m-80 -56.11 -41.59 75.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.895 -179.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 6.3 mmtp -77.8 -51.82 9.89 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 120.703 0.287 . . . . 0.0 111.66 -179.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 1.056 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -58.06 -40.86 82.07 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.862 -0.421 . . . . 0.0 109.862 179.689 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 679' ' ' ALA . . . . . 0.801 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.56 -33.76 69.38 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.423 179.028 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.74 -49.07 68.96 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.395 179.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 2.9 ttp -64.57 -22.37 66.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.906 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 682' ' ' LEU . . . . . 0.843 HD23 HD22 ' A' ' 659' ' ' LEU . 3.1 mm? -78.3 -2.99 40.7 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.446 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . 0.697 ' C ' HD12 ' A' ' 684' ' ' ILE . 37.7 mmt180 70.02 71.8 0.23 Allowed 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.979 0.418 . . . . 0.0 111.497 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . 0.697 HD12 ' C ' ' A' ' 683' ' ' ARG . 2.0 mp -122.22 141.9 35.59 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.073 179.401 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . 0.661 ' HD2' HG23 ' A' ' 684' ' ' ILE . 51.3 Cg_endo -69.67 119.42 6.37 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.511 2.141 . . . . 0.0 112.655 -179.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 8.3 mmmt -69.87 -21.89 63.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.095 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -65.35 -21.6 66.71 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.389 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 688' ' ' ALA . . . . . 0.758 ' HB3' ' HG2' ' A' ' 691' ' ' ARG . . . -72.58 115.75 12.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.873 0.368 . . . . 0.0 111.007 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 67.0 mm-40 -83.39 5.9 21.93 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.49 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -123.81 -15.19 7.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.946 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 691' ' ' ARG . . . . . 0.788 ' HG3' HD22 ' A' ' 692' ' ' LEU . 0.0 OUTLIER -53.42 -33.1 52.68 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-O 120.744 0.307 . . . . 0.0 110.951 -179.609 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . 0.788 HD22 ' HG3' ' A' ' 691' ' ' ARG . 3.2 mm? -70.57 -49.54 46.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.056 179.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.19 -39.65 68.46 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.501 -179.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 6.3 mtpt -64.01 -38.85 92.58 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.033 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 1.121 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 4.0 tp -65.08 -47.32 77.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.827 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.413 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 43.5 mt-30 -55.33 -46.8 76.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.105 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -76.95 -29.67 55.69 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.131 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 698' ' ' ALA . . . . . 0.415 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.97 -37.48 81.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.797 -179.506 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 699' ' ' TYR . . . . . 0.539 ' HB2' HD12 ' A' ' 703' ' ' LEU . 1.2 p90 -86.6 -33.5 20.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.032 0.444 . . . . 0.0 110.442 179.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 700' ' ' CYS . . . . . 0.513 ' HA ' HD23 ' A' ' 704' ' ' LEU . 1.8 m -65.78 -30.46 71.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.887 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -98.53 -1.52 40.92 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.549 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 702' ' ' TYR . . . . . 0.415 ' CD1' ' O ' ' A' ' 698' ' ' ALA . 7.6 m-85 -122.55 -75.94 0.59 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.791 0.329 . . . . 0.0 111.308 -179.87 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 703' ' ' LEU . . . . . 0.631 HD13 HD12 ' A' ' 660' ' ' ILE . 19.7 mt -56.0 -44.55 78.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.439 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.513 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.9 OUTLIER -54.84 -27.17 40.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.15 -179.91 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . 0.441 ' HB3' ' CE1' ' A' ' 632' ' ' HIS . 0.2 OUTLIER -67.99 -55.52 12.37 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.557 179.901 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 706' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -53.15 -46.62 68.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.147 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -74.82 -19.42 60.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.526 -179.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 40.0 t -88.99 -35.21 16.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.767 0.318 . . . . 0.0 111.21 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 709' ' ' LEU . . . . . 0.587 HD21 HE22 ' A' ' 636' ' ' GLN . 71.8 mt -56.67 150.06 16.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.184 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 710' ' ' SER . . . . . 0.428 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.5 OUTLIER -75.7 166.82 42.1 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.8 179.953 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . 0.428 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 11.4 Cg_endo -54.8 -26.08 45.99 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.542 2.161 . . . . 0.0 112.334 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.84 -53.35 58.43 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.747 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 713' ' ' GLU . . . . . 0.457 ' O ' HD12 ' A' ' 717' ' ' LEU . 5.7 mm-40 -60.21 -26.21 66.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.033 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 17.4 m170 -75.83 -54.38 7.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.944 0.402 . . . . 0.0 110.471 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 17.0 mtt180 -60.56 -47.62 85.4 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.461 -179.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.93 -54.17 34.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.568 -179.394 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . 0.468 HD13 ' HB3' ' A' ' 632' ' ' HIS . 73.9 mt -62.38 -41.93 99.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.978 -179.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -65.95 -54.25 28.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.836 0.35 . . . . 0.0 110.2 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 1.5 mmpt? -50.42 -33.57 21.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.331 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 720' ' ' GLU . . . . . 0.426 ' O ' ' HG2' ' A' ' 723' ' ' MET . 12.7 mt-10 -69.25 -55.36 10.76 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.578 179.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 721' ' ' VAL . . . . . 0.573 HG11 ' HB1' ' A' ' 627' ' ' ALA . 25.2 t -64.06 -54.99 24.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.922 -179.828 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . 0.446 ' O ' ' HG3' ' A' ' 725' ' ' LYS . 1.1 mp -49.16 -43.37 41.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.724 -179.524 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 723' ' ' MET . . . . . 0.531 ' O ' HD12 ' A' ' 727' ' ' ILE . 8.0 ptp -73.85 -40.48 63.25 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.562 -0.455 . . . . 0.0 109.942 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -51.08 -38.06 49.43 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.532 -179.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 725' ' ' LYS . . . . . 0.446 ' HG3' ' O ' ' A' ' 722' ' ' LEU . 0.0 OUTLIER -86.08 -34.78 20.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.732 0.301 . . . . 0.0 111.088 -179.787 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -65.35 -54.33 30.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.026 0.441 . . . . 0.0 110.789 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 727' ' ' ILE . . . . . 0.62 HG22 ' O ' ' A' ' 727' ' ' ILE . 4.1 mp -88.48 11.49 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.539 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 2.7 tt -59.12 -48.0 83.2 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.833 0.349 . . . . 0.0 111.094 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -60.51 -50.05 75.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.097 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 730' ' ' LYS . . . . . 0.405 ' HD2' HG23 ' A' ' 727' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.873 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 619' ' ' TRP . . . . . 0.456 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.736 0.303 . . . . 0.0 110.779 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . -66.3 169.48 32.35 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.452 -0.88 . . . . 0.0 111.907 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -64.15 -29.04 64.98 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.365 2.044 . . . . 0.0 111.862 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 46.4 m-80 -63.94 -38.61 91.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.932 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 623' ' ' VAL . . . . . 0.442 ' HB ' ' CG ' ' A' ' 619' ' ' TRP . 41.4 t -73.3 -36.65 49.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.116 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 624' ' ' GLN . . . . . 0.442 ' CG ' HD11 ' A' ' 722' ' ' LEU . 3.0 tm0? -59.41 -48.09 82.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.839 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.49 -49.41 66.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.024 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 9.6 tt -62.32 -31.19 71.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.063 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 627' ' ' ALA . . . . . 0.562 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -66.79 -52.16 47.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.3 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 1.3 m -57.14 -53.19 60.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.124 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 629' ' ' ILE . . . . . 0.678 HG21 HD23 ' A' ' 653' ' ' LEU . 18.8 mt -58.92 -39.84 78.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.054 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 4.1 tmmm? -59.81 -40.48 88.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.837 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 631' ' ' LYS . . . . . 0.452 ' HD3' HD22 ' A' ' 717' ' ' LEU . 4.8 tttm -66.08 -40.76 91.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.001 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 632' ' ' HIS . . . . . 0.749 ' CE1' HD11 ' A' ' 709' ' ' LEU . 67.3 t60 -68.34 -44.95 74.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.031 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.469 HD21 ' CD2' ' A' ' 702' ' ' TYR . 25.6 mt -56.53 -49.82 73.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.26 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 18.4 ptt180 -61.87 -41.72 98.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.841 0.353 . . . . 0.0 110.913 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.63 -19.49 60.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.25 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -89.1 -8.55 53.62 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.646 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 113.3 3.92 24.0 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.39 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 638' ' ' ILE . . . . . 0.429 HG21 ' CE2' ' A' ' 702' ' ' TYR . 17.2 mt -111.5 104.83 17.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-O 120.747 0.308 . . . . 0.0 111.267 -179.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -82.59 110.78 17.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.868 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 640' ' ' MET . . . . . 0.428 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.8 ttp -121.11 30.73 6.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.966 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.32 -29.81 71.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.873 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 642' ' ' GLU . . . . . 0.556 ' O ' HD12 ' A' ' 643' ' ' LEU . 12.0 mt-10 -71.57 -76.18 0.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.019 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 643' ' ' LEU . . . . . 0.556 HD12 ' O ' ' A' ' 642' ' ' GLU . 0.1 OUTLIER -179.75 139.24 0.32 Allowed Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.846 -179.99 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_endo -77.95 138.52 16.6 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.603 2.202 . . . . 0.0 112.455 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 645' ' ' LEU . . . . . 0.659 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.8 tp -134.9 151.21 50.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.229 0.538 . . . . 0.0 111.121 179.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 646' ' ' ILE . . . . . 0.632 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.2 tt -148.96 132.55 7.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.386 -0.824 . . . . 0.0 109.533 178.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 52.26 43.18 56.97 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.3 -0.952 . . . . 0.0 112.21 -179.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 68.71 6.61 51.49 Favored Glycine 0 C--N 1.334 0.453 0 C-N-CA 121.032 -0.604 . . . . 0.0 113.91 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 87.0 m -131.51 163.07 28.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 117.507 0.654 . . . . 0.0 111.513 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 650' ' ' GLU . . . . . 0.659 ' HA ' HD12 ' A' ' 645' ' ' LEU . 2.7 mt-10 -80.5 143.88 32.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.798 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 651' ' ' LEU . . . . . 0.614 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -135.0 144.93 47.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.344 -179.841 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -94.02 107.99 19.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.971 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 653' ' ' LEU . . . . . 0.678 HD23 HG21 ' A' ' 629' ' ' ILE . 7.2 mp -54.32 -42.89 70.67 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.997 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -61.44 -46.68 89.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.013 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 1.1 t -66.79 -35.6 80.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.743 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 656' ' ' PHE . . . . . 0.425 ' CZ ' ' HG ' ' A' ' 682' ' ' LEU . 0.2 OUTLIER -70.68 -42.46 70.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.887 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -59.78 -52.04 67.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.039 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 16.9 ttt180 -59.97 -43.41 95.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.093 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . 0.477 HD13 HD21 ' A' ' 682' ' ' LEU . 0.1 OUTLIER -56.84 -43.32 80.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.024 -179.845 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 660' ' ' ILE . . . . . 0.718 HG23 HG21 ' A' ' 669' ' ' VAL . 89.4 mt -64.26 -43.61 97.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.736 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -64.17 -45.89 86.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.052 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -61.23 -21.0 63.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.178 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.81 8.77 21.4 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.503 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 98.87 25.64 9.59 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.638 -0.792 . . . . 0.0 112.644 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 92.0 174.8 42.48 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.561 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 666' ' ' MET . . . . . 0.683 ' HG2' HG21 ' A' ' 660' ' ' ILE . 0.0 OUTLIER -69.66 -25.69 64.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.661 0.267 . . . . 0.0 111.09 179.863 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 667' ' ' GLN . . . . . 0.404 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 15.9 pt20 -59.1 -48.51 81.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.797 -179.358 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 668' ' ' GLN . . . . . 0.442 ' HG3' HD22 ' A' ' 672' ' ' LEU . 0.0 OUTLIER -64.82 -52.81 54.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.897 0.379 . . . . 0.0 111.225 -179.483 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 669' ' ' VAL . . . . . 0.718 HG21 HG23 ' A' ' 660' ' ' ILE . 57.5 t -49.54 -55.35 4.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.681 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 670' ' ' THR . . . . . 0.659 HG22 ' O ' ' A' ' 666' ' ' MET . 10.6 t -76.44 -48.53 19.38 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 -178.176 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 671' ' ' ASP . . . . . 0.456 ' N ' HG23 ' A' ' 670' ' ' THR . 5.0 t70 -66.31 -51.08 60.93 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -177.649 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 672' ' ' LEU . . . . . 0.442 HD22 ' HG3' ' A' ' 668' ' ' GLN . 11.1 mp -77.52 3.83 12.6 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -179.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 48.92 84.18 0.03 OUTLIER 'General case' 0 C--O 1.231 0.125 0 CA-C-O 120.936 0.398 . . . . 0.0 110.446 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 62.1 tttt -145.65 22.16 1.46 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.327 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 675' ' ' TRP . . . . . 1.109 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 34.9 m95 -61.13 -28.91 69.45 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 121.381 0.61 . . . . 0.0 110.125 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -56.02 -43.43 77.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.546 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.41 -51.61 11.5 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 120.687 0.28 . . . . 0.0 111.538 -179.279 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.979 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.01 -41.21 71.0 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 179.738 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 679' ' ' ALA . . . . . 0.827 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.55 -34.66 70.19 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.743 179.346 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -53.23 -48.54 68.08 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.452 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 3.9 ttm -63.81 -21.56 66.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.702 179.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 682' ' ' LEU . . . . . 0.477 HD21 HD13 ' A' ' 659' ' ' LEU . 2.2 mm? -80.48 -1.87 43.49 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.402 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . 0.752 ' C ' HD12 ' A' ' 684' ' ' ILE . 0.3 OUTLIER 71.23 71.74 0.18 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.887 0.375 . . . . 0.0 111.293 179.95 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . 0.752 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.7 mp -120.57 137.16 25.93 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.626 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . 0.427 ' HD2' HG23 ' A' ' 684' ' ' ILE . 41.8 Cg_endo -67.51 123.91 11.38 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.47 2.113 . . . . 0.0 112.328 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 686' ' ' LYS . . . . . 0.428 ' HE3' HG23 ' A' ' 687' ' ' THR . 0.7 OUTLIER -69.94 -13.7 62.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.412 -179.968 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 687' ' ' THR . . . . . 0.428 HG23 ' HE3' ' A' ' 686' ' ' LYS . 1.5 p -65.34 -22.28 66.8 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.748 0.309 . . . . 0.0 111.253 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 688' ' ' ALA . . . . . 0.453 ' CB ' ' HB2' ' A' ' 691' ' ' ARG . . . -88.46 100.16 12.83 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.889 0.376 . . . . 0.0 110.937 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 13.1 mp0 -68.53 -67.56 0.46 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.289 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -52.81 -19.26 2.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.872 -179.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 691' ' ' ARG . . . . . 0.658 HH22 HD22 ' A' ' 695' ' ' LEU . 0.0 OUTLIER -45.39 -42.04 9.76 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.783 0.325 . . . . 0.0 111.347 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . 0.428 HD13 ' HA ' ' A' ' 692' ' ' LEU . 3.6 mm? -56.58 -42.69 79.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.955 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.99 -37.18 69.9 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.79 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 1.3 ttpp -64.62 -40.23 95.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.241 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 1.109 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.4 OUTLIER -65.13 -44.08 89.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.254 179.517 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.461 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 2.0 mt-30 -55.48 -45.96 76.94 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.798 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -77.16 -29.66 54.59 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.073 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 698' ' ' ALA . . . . . 0.412 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.63 -39.03 84.66 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.599 -179.796 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 699' ' ' TYR . . . . . 0.461 ' CD2' ' CZ2' ' A' ' 675' ' ' TRP . 1.3 p90 -84.72 -32.78 23.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.88 0.371 . . . . 0.0 110.488 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 700' ' ' CYS . . . . . 0.472 ' HA ' HD23 ' A' ' 704' ' ' LEU . 32.6 t -66.03 -30.62 71.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.721 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -97.65 -2.07 42.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.329 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 702' ' ' TYR . . . . . 0.469 ' CD2' HD21 ' A' ' 633' ' ' LEU . 6.8 m-85 -121.61 -74.83 0.6 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.869 0.366 . . . . 0.0 111.245 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 703' ' ' LEU . . . . . 0.471 ' CD2' HD12 ' A' ' 660' ' ' ILE . 1.7 tp -58.37 -48.4 80.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.589 -179.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.472 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.6 OUTLIER -50.17 -47.62 54.38 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.861 0.362 . . . . 0.0 111.481 -179.663 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.66 -55.19 32.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.128 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 706' ' ' TYR . . . . . 0.513 ' CD1' HD12 ' A' ' 709' ' ' LEU . 57.9 t80 -66.78 -29.7 69.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.276 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -76.29 -18.82 58.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.43 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 36.6 p -95.87 -14.65 23.0 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.703 0.287 . . . . 0.0 111.437 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 709' ' ' LEU . . . . . 0.749 HD11 ' CE1' ' A' ' 632' ' ' HIS . 70.2 mt -56.46 151.12 13.83 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.939 0.4 . . . . 0.0 111.358 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 710' ' ' SER . . . . . 0.418 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.6 OUTLIER -78.76 169.73 19.38 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.603 179.66 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . 0.418 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 55.7 Cg_endo -70.06 -12.83 33.07 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.519 2.146 . . . . 0.0 112.851 -179.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -75.47 -56.78 4.37 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.847 0.356 . . . . 0.0 111.109 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 713' ' ' GLU . . . . . 0.699 ' CD ' HD22 ' A' ' 709' ' ' LEU . 0.0 OUTLIER -68.93 -25.41 64.56 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.689 179.939 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 714' ' ' HIS . . . . . 0.406 ' CE1' ' CE2' ' A' ' 706' ' ' TYR . 0.4 OUTLIER -70.03 -54.79 11.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.298 -0.41 . . . . 0.0 109.921 179.361 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 2.2 tpt180 -60.65 -40.31 91.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.056 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 27.6 ttp180 -65.33 -53.78 38.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.091 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . 0.591 HD12 ' HG3' ' A' ' 713' ' ' GLU . 47.1 mt -60.45 -41.48 94.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.795 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 718' ' ' GLU . . . . . 0.729 ' HG3' HD13 ' A' ' 722' ' ' LEU . 41.7 tt0 -66.99 -54.15 24.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.441 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.8 -31.6 27.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.482 -179.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 720' ' ' GLU . . . . . 0.425 ' O ' ' HG2' ' A' ' 723' ' ' MET . 18.4 mm-40 -72.06 -55.39 7.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.006 0.431 . . . . 0.0 110.514 179.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 721' ' ' VAL . . . . . 0.562 HG11 ' HB1' ' A' ' 627' ' ' ALA . 40.2 t -62.6 -54.6 31.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.757 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . 0.729 HD13 ' HG3' ' A' ' 718' ' ' GLU . 7.0 mp -53.6 -40.81 66.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.852 -179.389 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 723' ' ' MET . . . . . 0.722 ' O ' HD12 ' A' ' 727' ' ' ILE . 8.2 ptp -71.34 -39.15 71.52 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.024 179.551 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 724' ' ' GLU . . . . . 0.426 ' N ' ' HG3' ' A' ' 723' ' ' MET . 6.6 mm-40 -57.92 -31.32 66.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.119 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 725' ' ' LYS . . . . . 0.448 ' HD3' ' NE1' ' A' ' 619' ' ' TRP . 11.4 pttt -86.12 -34.45 20.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.443 -179.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 726' ' ' GLU . . . . . 0.409 ' N ' ' HG3' ' A' ' 725' ' ' LYS . 3.5 mm-40 -73.5 -47.55 40.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.282 -179.529 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 727' ' ' ILE . . . . . 0.722 HD12 ' O ' ' A' ' 723' ' ' MET . 4.0 mp -88.16 11.6 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.635 -179.789 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 3.2 tt -64.41 -35.75 81.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.817 0.341 . . . . 0.0 110.837 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -58.64 -43.6 89.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.985 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 1.7 mtmt . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.858 -179.992 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 619' ' ' TRP . . . . . 0.454 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.135 0 CA-C-O 120.598 0.237 . . . . 0.0 111.387 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 124.29 165.08 12.12 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.363 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -70.6 -41.93 2.88 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.596 2.197 . . . . 0.0 112.461 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 622' ' ' ASN . . . . . 0.413 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 7.1 p30 -66.75 -30.93 71.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.01 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 623' ' ' VAL . . . . . 0.454 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 55.5 t -74.96 -40.8 45.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.917 0.389 . . . . 0.0 110.442 179.391 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 35.7 tp60 -65.09 -34.59 78.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.951 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 81.6 mtm-85 -64.7 -50.72 65.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.248 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 626' ' ' LEU . . . . . 0.825 ' O ' HD13 ' A' ' 626' ' ' LEU . 2.0 tm? -62.02 -32.14 72.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.691 179.592 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -74.04 -53.92 8.96 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.744 -179.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 25.0 p -57.07 -42.38 80.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.24 -179.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 629' ' ' ILE . . . . . 0.595 HG22 ' CD1' ' A' ' 633' ' ' LEU . 55.4 mt -68.68 -40.48 81.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.882 0.373 . . . . 0.0 110.732 179.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 2.5 ttpt -62.0 -46.57 88.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.718 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 5.3 tttm -65.18 -40.52 94.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.088 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 632' ' ' HIS . . . . . 0.452 ' CE1' HD13 ' A' ' 709' ' ' LEU . 79.3 t60 -68.85 -44.85 72.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.084 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.613 HD13 ' SD ' ' A' ' 640' ' ' MET . 35.6 mt -56.21 -49.91 72.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.308 -179.623 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -62.73 -42.29 99.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.997 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.74 -16.1 61.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.299 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 636' ' ' GLN . . . . . 0.443 ' CG ' ' CE1' ' A' ' 632' ' ' HIS . 67.8 mm-40 -92.67 -9.12 42.0 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.563 -179.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 114.41 0.33 23.52 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.374 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 638' ' ' ILE . . . . . 0.555 HD11 ' OE1' ' A' ' 701' ' ' GLN . 11.4 mt -108.16 105.41 18.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 CA-C-O 120.767 0.318 . . . . 0.0 111.254 -179.531 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.29 109.82 17.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.851 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 640' ' ' MET . . . . . 0.613 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.7 mtp -118.16 28.71 8.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.961 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.88 -38.15 90.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.903 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -60.96 -76.4 0.05 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.997 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 643' ' ' LEU . . . . . 0.543 HD13 ' HD2' ' A' ' 644' ' ' PRO . 0.2 OUTLIER -178.74 123.28 0.24 Allowed Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.761 179.949 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 644' ' ' PRO . . . . . 0.543 ' HD2' HD13 ' A' ' 643' ' ' LEU . 29.6 Cg_endo -63.26 139.95 74.73 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.488 2.125 . . . . 0.0 112.33 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 645' ' ' LEU . . . . . 0.659 HD12 ' HA ' ' A' ' 650' ' ' GLU . 5.0 tp -142.01 153.2 44.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.269 0.557 . . . . 0.0 111.223 179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 646' ' ' ILE . . . . . 0.51 HD11 ' HA ' ' A' ' 695' ' ' LEU . 3.2 tt -149.84 133.76 8.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.466 178.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 49.72 43.43 37.99 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.192 -1.004 . . . . 0.0 111.98 -179.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 68.48 6.02 46.7 Favored Glycine 0 CA--C 1.521 0.427 0 C-N-CA 121.149 -0.548 . . . . 0.0 113.972 179.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.3 m -129.58 160.89 31.87 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 117.586 0.693 . . . . 0.0 111.697 -178.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 650' ' ' GLU . . . . . 0.659 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.9 OUTLIER -78.9 140.62 38.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.824 179.856 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 651' ' ' LEU . . . . . 0.632 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.63 144.92 48.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.14 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -96.86 111.65 23.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.866 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 653' ' ' LEU . . . . . 0.4 ' HB2' ' CD2' ' A' ' 626' ' ' LEU . 3.4 mm? -54.62 -37.77 66.01 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.89 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 654' ' ' ALA . . . . . 0.413 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -63.91 -46.0 86.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.893 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 33.8 t -66.71 -35.43 80.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.646 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 656' ' ' PHE . . . . . 0.405 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.3 OUTLIER -70.53 -44.58 67.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.783 179.852 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 36.2 t80 -58.01 -43.26 86.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.73 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -66.1 -43.59 86.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.692 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . 0.675 HD21 ' HE2' ' A' ' 681' ' ' MET . 0.1 OUTLIER -56.68 -52.39 65.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.215 -179.844 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 660' ' ' ILE . . . . . 0.721 HG23 HG21 ' A' ' 669' ' ' VAL . 57.1 mt -57.87 -45.19 87.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.049 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -64.61 -44.27 91.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.396 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -55.13 -22.9 18.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.412 -179.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 12.6 mtm -95.49 35.91 1.3 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.853 0.358 . . . . 0.0 110.845 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 88.23 -50.8 3.91 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.354 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 665' ' ' GLY . . . . . 0.413 ' O ' HG23 ' A' ' 669' ' ' VAL . . . 171.76 -174.73 45.23 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 121.025 -0.607 . . . . 0.0 111.914 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 666' ' ' MET . . . . . 0.587 ' O ' HG22 ' A' ' 670' ' ' THR . 11.1 tpt -73.08 -30.35 63.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.872 0.368 . . . . 0.0 110.899 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -57.65 -49.1 77.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.412 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 668' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.66 -52.7 62.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.858 0.361 . . . . 0.0 111.294 -179.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 669' ' ' VAL . . . . . 0.721 HG21 HG23 ' A' ' 660' ' ' ILE . 56.4 t -49.31 -55.41 4.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.792 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 670' ' ' THR . . . . . 0.587 HG22 ' O ' ' A' ' 666' ' ' MET . 14.1 t -76.09 -49.64 16.87 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -178.284 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 671' ' ' ASP . . . . . 0.465 ' N ' HG23 ' A' ' 670' ' ' THR . 63.8 m-20 -61.97 -51.07 69.57 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 -177.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 9.1 mp -78.93 5.2 12.14 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 48.87 83.63 0.04 OUTLIER 'General case' 0 C--O 1.231 0.122 0 CA-C-O 120.994 0.426 . . . . 0.0 110.535 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 14.8 mttm -142.46 22.98 2.0 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.188 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 675' ' ' TRP . . . . . 1.111 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 37.7 m95 -61.44 -27.62 68.69 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.358 0.599 . . . . 0.0 110.221 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 -57.3 -45.57 84.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.613 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.45 -51.63 12.58 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 120.703 0.287 . . . . 0.0 111.587 -179.355 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.975 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -54.9 -40.64 70.02 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 179.759 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 679' ' ' ALA . . . . . 0.849 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.78 -33.9 68.99 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.602 179.312 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.22 -50.37 64.88 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.417 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 681' ' ' MET . . . . . 0.675 ' HE2' HD21 ' A' ' 659' ' ' LEU . 2.8 mtp -62.11 -19.88 63.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.78 179.301 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 682' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -84.71 -1.5 56.27 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.384 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . 0.758 ' C ' HD12 ' A' ' 684' ' ' ILE . 23.3 mmm-85 70.86 71.69 0.19 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.946 0.403 . . . . 0.0 111.029 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . 0.758 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.6 mp -121.1 137.47 26.71 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.654 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . 0.418 ' HD2' HG23 ' A' ' 684' ' ' ILE . 38.9 Cg_endo -67.09 121.84 9.06 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.391 2.06 . . . . 0.0 112.381 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.91 -18.95 63.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.269 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -65.37 -22.15 66.77 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.241 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 688' ' ' ALA . . . . . 0.432 ' HB1' ' HG3' ' A' ' 691' ' ' ARG . . . -84.53 105.23 15.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.977 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 20.0 mp0 -70.12 -68.61 0.41 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.164 -179.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -51.73 -20.69 2.25 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.798 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 691' ' ' ARG . . . . . 0.438 ' CZ ' HG13 ' A' ' 684' ' ' ILE . 0.0 OUTLIER -47.98 -36.4 12.59 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.865 0.364 . . . . 0.0 111.121 179.873 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -65.38 -45.72 82.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.898 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.02 -37.9 69.69 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.855 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.92 -39.64 94.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.08 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 1.111 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.2 OUTLIER -65.95 -42.15 90.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.135 179.408 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.432 ' O ' ' CD1' ' A' ' 699' ' ' TYR . 23.5 mt-30 -57.48 -44.09 84.6 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.786 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -77.31 -30.0 53.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.157 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 698' ' ' ALA . . . . . 0.424 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -66.6 -37.75 85.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.442 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 699' ' ' TYR . . . . . 0.554 ' CE2' ' HE2' ' A' ' 666' ' ' MET . 1.8 p90 -86.54 -34.91 19.81 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.108 0.48 . . . . 0.0 109.961 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 700' ' ' CYS . . . . . 0.453 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 52.4 t -61.01 -30.59 70.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.617 179.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 701' ' ' GLN . . . . . 0.555 ' OE1' HD11 ' A' ' 638' ' ' ILE . 0.3 OUTLIER -99.75 -3.4 32.91 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.351 179.921 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 702' ' ' TYR . . . . . 0.496 ' CZ ' HG21 ' A' ' 638' ' ' ILE . 4.8 m-85 -115.47 -77.16 0.57 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.882 0.372 . . . . 0.0 111.366 -179.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 703' ' ' LEU . . . . . 0.411 ' CD2' HD12 ' A' ' 660' ' ' ILE . 1.9 tp -63.6 -40.63 97.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.662 -179.266 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.545 HD23 ' CE2' ' A' ' 699' ' ' TYR . 0.5 OUTLIER -54.06 -50.63 66.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.902 0.382 . . . . 0.0 111.207 -179.68 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -54.3 -54.6 38.08 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.897 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 706' ' ' TYR . . . . . 0.565 ' O ' HD22 ' A' ' 709' ' ' LEU . 20.4 t80 -57.78 -28.87 64.38 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.415 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -96.99 -1.82 44.79 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -106.82 -20.82 13.22 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.584 0.23 . . . . 0.0 111.602 -179.436 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 709' ' ' LEU . . . . . 0.565 HD22 ' O ' ' A' ' 706' ' ' TYR . 0.2 OUTLIER -77.54 176.15 9.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.799 0.333 . . . . 0.0 110.97 -179.846 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.16 164.98 57.38 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.158 -179.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -66.68 -28.93 43.85 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.653 2.235 . . . . 0.0 112.102 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -48.86 -48.75 41.71 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.702 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 713' ' ' GLU . . . . . 0.516 ' HB2' HD11 ' A' ' 709' ' ' LEU . 3.5 mm-40 -61.34 -26.38 67.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.059 179.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -76.04 -54.28 7.09 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.989 0.423 . . . . 0.0 110.322 179.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.31 -43.27 96.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.336 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.61 -53.96 34.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.824 0.345 . . . . 0.0 111.168 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . 0.451 ' O ' HG23 ' A' ' 721' ' ' VAL . 76.2 mt -62.25 -42.12 99.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.092 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -68.84 -54.21 17.01 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.47 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 6.4 mmtt -50.81 -31.85 18.26 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.106 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 720' ' ' GLU . . . . . 0.428 ' O ' ' HG2' ' A' ' 723' ' ' MET . 13.1 mt-10 -70.96 -55.5 8.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.497 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 721' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 717' ' ' LEU . 35.4 t -63.2 -54.84 27.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.872 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -52.9 -41.11 64.08 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.942 -179.263 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 723' ' ' MET . . . . . 0.583 ' HB2' HD13 ' A' ' 727' ' ' ILE . 15.4 ptp -73.92 -40.72 62.91 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.066 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -54.54 -40.73 68.95 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.312 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 725' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.13 -37.56 18.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.289 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.65 -57.28 8.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.875 0.369 . . . . 0.0 111.029 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 727' ' ' ILE . . . . . 0.632 HG22 ' O ' ' A' ' 727' ' ' ILE . 4.1 mp -88.19 11.64 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.676 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 728' ' ' LEU . . . . . 0.484 ' O ' HD23 ' A' ' 728' ' ' LEU . 1.8 tt -52.22 -41.63 62.89 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.827 0.346 . . . . 0.0 111.159 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -76.4 -59.91 2.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.934 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 13.2 mtmt . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.236 -0.888 . . . . 0.0 110.891 -179.966 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 619' ' ' TRP . . . . . 0.491 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.123 0 CA-C-O 120.643 0.259 . . . . 0.0 111.248 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 124.41 165.24 12.14 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.484 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -68.0 -35.38 20.5 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 122.575 2.184 . . . . 0.0 112.222 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 622' ' ' ASN . . . . . 0.577 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 11.0 p30 -66.65 -39.36 88.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.852 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 623' ' ' VAL . . . . . 0.453 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 41.2 t -72.95 -40.84 60.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.77 179.613 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 624' ' ' GLN . . . . . 0.688 ' CG ' HD11 ' A' ' 722' ' ' LEU . 3.2 tm0? -58.0 -41.42 83.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.641 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 625' ' ' ARG . . . . . 0.414 ' O ' HD12 ' A' ' 629' ' ' ILE . 0.0 OUTLIER -68.03 -47.7 67.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.67 179.85 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 626' ' ' LEU . . . . . 0.629 ' O ' HD23 ' A' ' 626' ' ' LEU . 5.6 tt -62.22 -32.92 73.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.004 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -73.92 -50.01 22.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.273 -179.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.08 -47.14 81.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.056 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 629' ' ' ILE . . . . . 0.619 HG21 HD23 ' A' ' 653' ' ' LEU . 12.1 mt -65.42 -41.22 90.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.046 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 9.4 ttpt -61.7 -50.98 70.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.797 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 7.2 tttm -56.58 -41.0 76.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.168 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 632' ' ' HIS . . . . . 0.686 ' HB2' HD13 ' A' ' 717' ' ' LEU . 80.7 t60 -70.97 -43.29 68.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.309 -179.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.482 HD13 ' SD ' ' A' ' 640' ' ' MET . 48.1 mt -56.28 -48.01 77.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.166 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 634' ' ' ARG . . . . . 0.402 ' HG3' ' N ' ' A' ' 635' ' ' SER . 38.3 ptt180 -66.04 -41.07 91.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.813 0.34 . . . . 0.0 110.626 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 635' ' ' SER . . . . . 0.402 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 0.1 OUTLIER -73.76 -11.56 60.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.184 179.638 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -98.74 -7.73 27.2 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.605 -0.271 . . . . 0.0 111.659 -179.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 115.52 -0.01 21.89 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.508 -0.853 . . . . 0.0 112.542 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 638' ' ' ILE . . . . . . . . . . . . . 14.5 mt -109.4 104.71 17.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.662 0.268 . . . . 0.0 111.223 -179.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.92 113.55 15.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.829 0.347 . . . . 0.0 110.964 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 640' ' ' MET . . . . . 0.482 ' SD ' HD13 ' A' ' 633' ' ' LEU . 2.0 ttp -123.73 31.49 5.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.859 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.7 -33.72 71.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.934 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 642' ' ' GLU . . . . . 0.612 ' HB3' HD23 ' A' ' 643' ' ' LEU . 18.4 mt-10 -70.28 -78.33 0.07 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.893 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 643' ' ' LEU . . . . . 0.612 HD23 ' HB3' ' A' ' 642' ' ' GLU . 2.0 pt? -177.59 132.53 0.34 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.877 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 644' ' ' PRO . . . . . 0.41 ' HB2' HD11 ' A' ' 651' ' ' LEU . 95.4 Cg_endo -79.67 135.3 11.47 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.531 2.154 . . . . 0.0 112.284 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 645' ' ' LEU . . . . . 0.586 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.6 tp -129.09 152.42 48.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.237 0.542 . . . . 0.0 111.216 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 646' ' ' ILE . . . . . 0.672 HD11 ' HA ' ' A' ' 695' ' ' LEU . 4.2 tt -149.74 133.95 8.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.921 179.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.41 38.85 58.38 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.362 -0.923 . . . . 0.0 112.198 -179.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.14 8.01 64.18 Favored Glycine 0 C--N 1.332 0.335 0 C-N-CA 120.981 -0.628 . . . . 0.0 113.71 179.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.3 m -134.38 164.18 28.01 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 117.341 0.571 . . . . 0.0 111.43 -179.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 650' ' ' GLU . . . . . 0.586 ' HA ' HD12 ' A' ' 645' ' ' LEU . 13.2 mt-10 -79.98 146.0 32.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.833 179.858 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 651' ' ' LEU . . . . . 0.612 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.54 144.93 48.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.381 -179.824 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -96.91 109.8 22.44 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.859 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 653' ' ' LEU . . . . . 0.619 HD23 HG21 ' A' ' 629' ' ' ILE . 6.8 mp -54.17 -35.96 62.86 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.284 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 654' ' ' ALA . . . . . 0.577 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -65.59 -43.47 89.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.109 -179.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -73.01 -34.73 66.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.61 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 656' ' ' PHE . . . . . 0.451 ' CZ ' ' HG ' ' A' ' 682' ' ' LEU . 0.2 OUTLIER -70.92 -47.98 56.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.801 179.866 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -58.71 -52.81 64.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.098 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 2.6 ptm85 -59.1 -40.14 84.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.853 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . 0.522 HD23 HD12 ' A' ' 678' ' ' LEU . 0.6 OUTLIER -60.47 -48.78 80.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.332 -179.704 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 660' ' ' ILE . . . . . 0.628 HG23 HG21 ' A' ' 669' ' ' VAL . 29.2 mt -56.71 -45.22 82.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-O 120.834 0.349 . . . . 0.0 110.561 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -63.96 -39.79 94.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.915 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -74.48 -13.9 60.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.486 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -94.24 36.63 1.13 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.716 0.294 . . . . 0.0 111.164 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 73.64 31.57 60.44 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.365 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 665' ' ' GLY . . . . . 0.513 ' O ' HG23 ' A' ' 669' ' ' VAL . . . 82.47 173.15 48.83 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.365 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 666' ' ' MET . . . . . 0.49 ' HE1' ' HB ' ' A' ' 669' ' ' VAL . 0.0 OUTLIER -71.17 -40.55 71.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.738 0.304 . . . . 0.0 111.062 179.985 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -52.57 -43.77 65.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.453 -179.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 668' ' ' GLN . . . . . 0.416 ' HG3' HD11 ' A' ' 672' ' ' LEU . 0.0 OUTLIER -64.81 -40.86 95.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.935 0.398 . . . . 0.0 110.832 179.937 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 669' ' ' VAL . . . . . 0.628 HG21 HG23 ' A' ' 660' ' ' ILE . 58.7 t -57.88 -55.82 19.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.434 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 670' ' ' THR . . . . . 0.497 HG23 ' N ' ' A' ' 671' ' ' ASP . 8.8 t -75.98 -53.88 7.71 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -178.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 671' ' ' ASP . . . . . 0.497 ' N ' HG23 ' A' ' 670' ' ' THR . 19.2 t0 -54.21 -50.97 65.88 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -178.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 672' ' ' LEU . . . . . 0.416 HD11 ' HG3' ' A' ' 668' ' ' GLN . 25.0 mt -77.77 -1.75 32.95 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 -179.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 24.4 mttt 49.46 82.7 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 121.09 0.471 . . . . 0.0 110.433 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 40.0 mttt -146.31 22.47 1.34 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.926 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 675' ' ' TRP . . . . . 1.106 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 31.9 m95 -57.24 -31.02 65.11 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 121.445 0.64 . . . . 0.0 110.073 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -56.84 -40.79 76.72 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.411 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.52 -51.62 10.42 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 120.776 0.322 . . . . 0.0 111.409 -179.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.987 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -57.48 -37.4 72.86 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.591 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 679' ' ' ALA . . . . . 0.875 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.48 -37.54 71.29 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.429 179.284 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -53.09 -46.29 68.57 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.314 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 35.0 mtp -65.24 -24.51 67.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.564 179.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 682' ' ' LEU . . . . . 0.454 HD23 ' O ' ' A' ' 678' ' ' LEU . 3.3 mm? -78.15 -2.07 35.73 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.535 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . 0.667 ' C ' HD12 ' A' ' 684' ' ' ILE . 1.6 mpp_? 68.68 71.79 0.28 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.883 0.373 . . . . 0.0 111.401 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . 0.667 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.9 mp -124.25 137.53 29.26 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.352 179.525 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . 0.402 ' HD2' HG23 ' A' ' 684' ' ' ILE . 24.8 Cg_endo -62.04 116.08 3.24 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.332 2.022 . . . . 0.0 112.298 -179.821 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -20.19 66.33 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.95 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 12.7 p -67.65 -23.87 65.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.204 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 688' ' ' ALA . . . . . 0.611 ' HB3' ' HG2' ' A' ' 691' ' ' ARG . . . -64.64 111.02 2.55 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.986 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 19.9 mm-40 -83.06 4.85 24.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.559 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -121.78 -16.64 7.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.65 179.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 691' ' ' ARG . . . . . 0.818 ' HG3' HD22 ' A' ' 692' ' ' LEU . 2.3 ppt_? -52.66 -32.07 40.37 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.473 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . 0.818 HD22 ' HG3' ' A' ' 691' ' ' ARG . 2.7 mm? -70.51 -54.54 11.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.729 0.299 . . . . 0.0 111.488 -179.785 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.78 -39.03 70.19 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.406 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 694' ' ' LYS . . . . . 0.406 ' O ' ' HB2' ' A' ' 698' ' ' ALA . 0.7 OUTLIER -63.55 -37.36 87.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.979 0.419 . . . . 0.0 109.98 179.442 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 1.106 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 3.9 tp -65.54 -47.76 74.77 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.854 179.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.432 ' HA ' ' CD2' ' A' ' 699' ' ' TYR . 14.7 tt0 -55.19 -47.8 74.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.254 -179.621 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -77.2 -29.81 54.46 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.247 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 698' ' ' ALA . . . . . 0.417 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.78 -37.06 81.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.754 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 699' ' ' TYR . . . . . 0.482 ' CZ ' ' HE3' ' A' ' 666' ' ' MET . 1.4 p90 -86.28 -34.95 20.21 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.008 0.432 . . . . 0.0 110.361 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 700' ' ' CYS . . . . . 0.412 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 1.7 m -64.23 -30.57 71.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.784 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 25.0 tt0 -97.3 -3.44 40.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.451 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 702' ' ' TYR . . . . . 0.417 ' CD1' ' O ' ' A' ' 698' ' ' ALA . 5.6 m-85 -117.42 -78.59 0.58 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.824 0.345 . . . . 0.0 111.315 -179.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 703' ' ' LEU . . . . . 0.544 HD13 HD12 ' A' ' 660' ' ' ILE . 77.9 mt -58.29 -45.78 87.32 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.532 -179.535 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.471 HD23 ' CE1' ' A' ' 699' ' ' TYR . 1.1 mm? -55.25 -49.05 73.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.919 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . 0.64 ' O ' HD13 ' A' ' 709' ' ' LEU . 2.2 m -54.68 -55.68 27.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.299 179.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 706' ' ' TYR . . . . . 0.442 ' O ' HD21 ' A' ' 709' ' ' LEU . 14.3 t80 -47.44 -38.63 13.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.689 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -96.89 0.28 48.84 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -81.35 -19.71 42.19 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 709' ' ' LEU . . . . . 0.64 HD13 ' O ' ' A' ' 705' ' ' SER . 0.0 OUTLIER -92.27 -176.64 4.41 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.002 0.43 . . . . 0.0 111.458 -179.599 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 710' ' ' SER . . . . . 0.445 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.6 OUTLIER -84.7 168.59 20.19 Favored Pre-proline 0 C--N 1.331 -0.208 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.997 -179.804 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . 0.445 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 19.0 Cg_endo -59.01 -19.37 47.98 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.596 2.198 . . . . 0.0 112.569 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -59.36 -52.41 65.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.764 0.316 . . . . 0.0 110.73 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 713' ' ' GLU . . . . . 0.447 ' HB2' ' HG ' ' A' ' 709' ' ' LEU . 4.8 mm-40 -64.19 -25.69 68.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.842 179.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -74.42 -54.7 7.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.094 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.19 -34.78 79.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.394 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.08 -53.97 25.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.75 0.309 . . . . 0.0 111.045 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . 0.686 HD13 ' HB2' ' A' ' 632' ' ' HIS . 43.8 mt -65.4 -36.73 84.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.055 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 718' ' ' GLU . . . . . 0.581 ' HG2' HD22 ' A' ' 722' ' ' LEU . 37.2 tt0 -71.7 -54.22 11.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.482 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 2.5 mmtm -54.55 -30.91 55.39 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.207 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 720' ' ' GLU . . . . . 0.447 ' O ' ' HG2' ' A' ' 723' ' ' MET . 3.4 mm-40 -71.56 -55.8 7.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.991 0.424 . . . . 0.0 110.508 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 721' ' ' VAL . . . . . 0.539 HG23 ' O ' ' A' ' 717' ' ' LEU . 42.3 t -62.8 -50.75 78.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.915 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . 0.688 HD11 ' CG ' ' A' ' 624' ' ' GLN . 9.4 mp -56.93 -37.97 72.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.89 -179.24 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 723' ' ' MET . . . . . 0.551 ' O ' HD12 ' A' ' 727' ' ' ILE . 13.7 ptp -74.16 -39.13 63.46 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.26 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 724' ' ' GLU . . . . . 0.427 ' N ' ' HG3' ' A' ' 723' ' ' MET . 3.8 mt-10 -60.52 -31.0 70.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.057 -179.783 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 725' ' ' LYS . . . . . 0.417 ' HD2' ' CE2' ' A' ' 619' ' ' TRP . 9.5 pttt -86.09 -41.04 15.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.304 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -69.97 -50.6 40.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.155 -179.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 727' ' ' ILE . . . . . 0.784 HG23 ' HE3' ' A' ' 730' ' ' LYS . 4.2 mp -88.13 11.61 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.631 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 2.5 tt -57.8 -45.49 85.99 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.808 0.337 . . . . 0.0 111.058 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -60.7 -56.24 23.6 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.985 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 730' ' ' LYS . . . . . 0.784 ' HE3' HG23 ' A' ' 727' ' ' ILE . 28.5 mtmt . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.878 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 619' ' ' TRP . . . . . 0.457 ' CE2' ' HD2' ' A' ' 725' ' ' LYS . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.16 0 CA-C-O 120.562 0.22 . . . . 0.0 111.43 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 116.63 158.25 11.24 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.438 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.81 -37.62 15.44 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.589 2.193 . . . . 0.0 112.048 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 622' ' ' ASN . . . . . 0.632 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 18.4 m-80 -67.73 -33.54 75.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.73 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 623' ' ' VAL . . . . . 0.451 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 60.5 t -70.15 -42.59 79.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.59 179.591 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 624' ' ' GLN . . . . . 0.406 ' OE1' HD12 ' A' ' 722' ' ' LEU . 42.6 tp60 -62.92 -38.11 89.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.46 179.609 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.37 -49.63 74.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.395 179.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 9.8 tt -67.7 -28.55 67.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.828 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -73.86 -49.21 26.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.139 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -58.81 -48.15 82.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.026 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 629' ' ' ILE . . . . . 0.55 HG22 HD11 ' A' ' 633' ' ' LEU . 20.5 mt -65.28 -38.84 83.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.984 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 630' ' ' LYS . . . . . 0.421 ' HA ' HD12 ' A' ' 633' ' ' LEU . 0.0 OUTLIER -62.02 -47.26 85.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.893 179.98 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -63.63 -40.22 96.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.984 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 632' ' ' HIS . . . . . 0.51 ' HB2' HD13 ' A' ' 717' ' ' LEU . 75.8 t60 -67.85 -42.89 80.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.858 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.598 HD13 ' SD ' ' A' ' 640' ' ' MET . 13.7 mt -56.58 -49.93 73.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.13 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -61.47 -41.54 97.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.67 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 11.8 t -73.56 -16.88 61.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.158 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -93.72 -9.58 37.23 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.57 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 119.95 -10.08 11.19 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.576 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 638' ' ' ILE . . . . . 0.65 ' N ' HD12 ' A' ' 638' ' ' ILE . 3.3 mp -98.96 104.67 16.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.733 0.302 . . . . 0.0 111.114 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 1.2 m -77.18 113.12 14.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.889 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 640' ' ' MET . . . . . 0.598 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.9 mtp -128.37 31.01 5.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.887 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -62.89 -39.3 94.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.937 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -66.95 -77.83 0.07 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.001 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -176.43 140.96 0.53 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.839 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 644' ' ' PRO . . . . . 0.517 ' HB2' HD11 ' A' ' 651' ' ' LEU . 87.1 Cg_endo -78.23 147.95 23.71 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.604 2.203 . . . . 0.0 112.499 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 645' ' ' LEU . . . . . 0.689 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.8 tp -141.36 150.9 43.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.201 0.524 . . . . 0.0 111.159 179.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 646' ' ' ILE . . . . . 0.593 HD11 ' HA ' ' A' ' 695' ' ' LEU . 0.8 OUTLIER -149.58 132.99 7.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.634 179.004 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.04 41.02 59.43 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.339 -0.934 . . . . 0.0 112.176 -179.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 69.96 6.91 58.14 Favored Glycine 0 C--N 1.333 0.373 0 C-N-CA 120.969 -0.634 . . . . 0.0 113.786 179.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.8 m -131.23 162.13 30.69 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 117.372 0.586 . . . . 0.0 111.512 -179.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 650' ' ' GLU . . . . . 0.689 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.1 OUTLIER -77.92 144.04 37.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.773 179.775 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 651' ' ' LEU . . . . . 0.597 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -135.39 145.11 46.99 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.098 0.475 . . . . 0.0 111.296 -179.638 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -96.93 110.75 23.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.897 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 653' ' ' LEU . . . . . 0.415 HD13 ' HA ' ' A' ' 653' ' ' LEU . 3.5 mm? -52.19 -30.15 25.72 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.976 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 654' ' ' ALA . . . . . 0.632 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -71.69 -44.64 63.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.044 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 4.2 t -69.36 -34.42 74.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.547 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 656' ' ' PHE . . . . . 0.444 ' HD2' HD23 ' A' ' 651' ' ' LEU . 0.2 OUTLIER -71.29 -47.02 59.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.778 179.847 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 657' ' ' PHE . . . . . 0.457 ' HD1' HD21 ' A' ' 703' ' ' LEU . 89.4 t80 -56.83 -50.89 71.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.841 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 5.9 mtm180 -60.2 -41.63 93.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.718 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.66 -48.33 75.2 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.98 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 660' ' ' ILE . . . . . 0.742 HG21 ' HG2' ' A' ' 666' ' ' MET . 14.0 mt -59.94 -44.64 94.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.827 179.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 13.4 t30 -61.02 -44.43 97.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.888 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -67.14 -13.95 62.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.352 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 36.5 mmm -94.57 36.49 1.16 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.776 0.322 . . . . 0.0 111.102 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 65.04 44.24 94.64 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.588 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 81.51 172.73 47.21 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.549 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 666' ' ' MET . . . . . 0.742 ' HG2' HG21 ' A' ' 660' ' ' ILE . 0.0 OUTLIER -73.01 -31.66 64.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.744 0.307 . . . . 0.0 111.123 179.919 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 667' ' ' GLN . . . . . 0.405 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 12.6 pt20 -56.94 -44.09 82.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.185 -179.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 668' ' ' GLN . . . . . 0.415 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -64.87 -52.15 58.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.956 0.408 . . . . 0.0 110.842 -179.901 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 669' ' ' VAL . . . . . 0.654 HG21 HG23 ' A' ' 660' ' ' ILE . 80.4 t -49.25 -55.77 3.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.619 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 670' ' ' THR . . . . . 0.534 HG22 ' O ' ' A' ' 666' ' ' MET . 14.5 t -76.28 -50.29 14.76 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -178.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 671' ' ' ASP . . . . . 0.481 ' N ' HG23 ' A' ' 670' ' ' THR . 6.1 t0 -63.32 -51.25 66.79 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -177.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 672' ' ' LEU . . . . . 0.415 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 10.5 mp -76.68 2.68 13.48 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -178.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 48.89 85.62 0.03 OUTLIER 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.987 0.423 . . . . 0.0 110.494 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -147.13 22.07 1.21 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.209 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 675' ' ' TRP . . . . . 1.152 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 38.1 m95 -60.15 -27.47 67.11 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 121.358 0.599 . . . . 0.0 110.16 179.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -55.44 -44.36 76.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.714 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 12.1 mttm -77.08 -51.6 10.76 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 120.748 0.309 . . . . 0.0 111.539 -179.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 1.012 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.43 -40.94 72.15 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 109.786 -0.449 . . . . 0.0 109.786 179.694 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 679' ' ' ALA . . . . . 0.827 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.62 -35.06 70.33 Favored 'General case' 0 C--N 1.334 -0.073 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.828 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -53.21 -47.64 68.78 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.504 179.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -19.19 65.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.066 179.628 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 682' ' ' LEU . . . . . 0.495 HD23 ' O ' ' A' ' 678' ' ' LEU . 3.2 mm? -80.99 -2.8 49.35 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.632 -179.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . 0.771 ' C ' HD12 ' A' ' 684' ' ' ILE . 8.4 mmm180 73.68 71.88 0.12 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.869 0.366 . . . . 0.0 111.465 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . 0.771 HD12 ' C ' ' A' ' 683' ' ' ARG . 3.2 mp -134.25 138.46 30.41 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.323 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . 0.542 ' HD2' HG23 ' A' ' 684' ' ' ILE . 28.1 Cg_endo -63.0 125.35 15.7 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.498 2.132 . . . . 0.0 112.763 -179.514 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -69.96 -23.9 63.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.023 179.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.36 -23.93 67.11 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.289 -179.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -71.34 109.16 5.17 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.826 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -70.79 -68.88 0.4 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.971 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -52.52 -18.53 1.75 Allowed 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 691' ' ' ARG . . . . . 0.439 ' HD3' HD22 ' A' ' 692' ' ' LEU . 0.0 OUTLIER -50.25 -33.96 21.48 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.795 0.331 . . . . 0.0 110.779 179.764 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . 0.439 HD22 ' HD3' ' A' ' 691' ' ' ARG . 4.3 mm? -70.27 -48.04 58.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.913 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.1 -38.41 69.36 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.316 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 2.7 tptt -61.71 -40.63 95.7 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.088 0.47 . . . . 0.0 110.117 179.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 1.152 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.3 OUTLIER -66.89 -43.79 82.54 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.399 179.551 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.49 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 5.2 tp60 -55.42 -46.91 76.63 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.76 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -77.18 -29.37 54.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.753 179.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 698' ' ' ALA . . . . . 0.429 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -68.1 -40.58 82.57 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.64 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 699' ' ' TYR . . . . . 0.498 ' CD2' ' CZ2' ' A' ' 675' ' ' TRP . 0.7 OUTLIER -84.16 -31.13 25.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.955 0.407 . . . . 0.0 110.657 -179.94 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 700' ' ' CYS . . . . . 0.451 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 41.7 t -67.69 -30.4 69.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.877 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -101.14 -1.78 33.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.787 -179.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 702' ' ' TYR . . . . . 0.439 ' CE2' HG21 ' A' ' 638' ' ' ILE . 4.3 m-85 -115.55 -78.85 0.58 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.809 0.337 . . . . 0.0 111.7 -179.508 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 703' ' ' LEU . . . . . 0.457 HD21 ' HD1' ' A' ' 657' ' ' PHE . 2.7 tp -63.2 -38.85 92.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.829 -179.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.451 ' HB2' ' O ' ' A' ' 700' ' ' CYS . 0.6 OUTLIER -50.83 -56.66 11.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.471 -179.557 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 22.7 p -54.42 -49.32 70.23 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.173 -179.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 706' ' ' TYR . . . . . 0.637 ' O ' HD22 ' A' ' 709' ' ' LEU . 10.5 t80 -62.36 -29.14 70.25 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.345 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -96.8 -1.27 46.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.823 -179.563 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 1.5 t -112.31 -18.18 12.56 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.603 0.239 . . . . 0.0 111.501 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 709' ' ' LEU . . . . . 0.637 HD22 ' O ' ' A' ' 706' ' ' TYR . 0.2 OUTLIER -74.09 175.19 7.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.759 0.314 . . . . 0.0 110.992 -179.918 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.44 166.15 47.4 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.228 -179.761 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -67.94 -27.45 36.69 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.646 2.23 . . . . 0.0 112.119 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -52.2 -50.51 61.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.633 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 713' ' ' GLU . . . . . 0.462 ' HB2' ' CD1' ' A' ' 709' ' ' LEU . 3.3 mm-40 -58.08 -26.6 62.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.193 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 714' ' ' HIS . . . . . 0.581 ' CD2' HD21 ' A' ' 709' ' ' LEU . 5.6 m170 -75.88 -53.62 8.17 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.935 0.398 . . . . 0.0 110.61 179.732 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 4.4 tpp180 -59.78 -45.32 92.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.385 -179.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -54.23 31.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.443 -179.452 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . 0.51 HD13 ' HB2' ' A' ' 632' ' ' HIS . 71.2 mt -62.04 -44.06 97.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.816 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -64.72 -53.78 41.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.164 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 6.7 mmtt -50.15 -34.22 21.63 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.152 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 720' ' ' GLU . . . . . 0.437 ' O ' ' HG2' ' A' ' 723' ' ' MET . 1.1 mm-40 -68.16 -55.47 12.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.012 0.434 . . . . 0.0 110.404 179.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 31.3 t -62.84 -54.98 26.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.977 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . 0.406 HD12 ' OE1' ' A' ' 624' ' ' GLN . 1.2 mp -49.0 -43.76 40.52 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.765 -179.312 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 723' ' ' MET . . . . . 0.698 ' O ' HD12 ' A' ' 727' ' ' ILE . 17.4 ptp -73.6 -41.31 63.01 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.456 -0.498 . . . . 0.0 109.792 179.416 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -57.37 -29.47 64.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.461 -179.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 725' ' ' LYS . . . . . 0.457 ' HD2' ' CE2' ' A' ' 619' ' ' TRP . 9.4 ptmm? -86.02 -38.88 17.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.329 -179.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 726' ' ' GLU . . . . . 0.403 ' N ' ' HG3' ' A' ' 725' ' ' LYS . 1.7 mm-40 -71.3 -49.92 37.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.017 -179.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 727' ' ' ILE . . . . . 0.698 HD12 ' O ' ' A' ' 723' ' ' MET . 3.7 mp -88.36 11.45 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.629 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 1.6 tt -58.77 -49.48 77.49 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.824 0.345 . . . . 0.0 110.94 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -71.89 -46.1 58.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 10.3 mtpt . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.878 -179.965 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 619' ' ' TRP . . . . . 0.535 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.124 0 CA-C-O 120.671 0.272 . . . . 0.0 111.183 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 119.0 166.12 13.36 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.495 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -67.54 -36.49 19.64 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.508 2.139 . . . . 0.0 112.127 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -65.01 -42.17 94.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.842 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 623' ' ' VAL . . . . . 0.458 HG21 ' HB2' ' A' ' 619' ' ' TRP . 47.4 t -68.53 -37.09 77.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.926 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 624' ' ' GLN . . . . . 0.509 ' CG ' HD21 ' A' ' 722' ' ' LEU . 6.3 tm0? -62.1 -41.81 98.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.8 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.64 -47.03 76.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.679 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 7.1 tt -67.07 -26.62 66.82 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.96 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 627' ' ' ALA . . . . . 0.475 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -73.95 -54.06 8.74 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.363 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 30.8 p -57.92 -41.83 83.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.03 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 29.0 mt -69.28 -42.52 81.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.816 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.48 -43.87 98.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.765 179.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 1.6 tttm -63.01 -42.21 99.78 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.852 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 632' ' ' HIS . . . . . 0.64 ' HB2' HD13 ' A' ' 717' ' ' LEU . 77.8 t60 -67.41 -42.4 83.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.898 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.644 HD13 ' SD ' ' A' ' 640' ' ' MET . 58.0 mt -55.9 -49.48 73.3 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.338 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 634' ' ' ARG . . . . . 0.49 ' HG3' ' N ' ' A' ' 635' ' ' SER . 0.0 OUTLIER -64.22 -40.44 96.05 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.937 -179.972 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 635' ' ' SER . . . . . 0.49 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 0.1 OUTLIER -73.89 -16.09 61.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.142 179.765 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 636' ' ' GLN . . . . . 0.444 ' CG ' ' CE1' ' A' ' 632' ' ' HIS . 14.0 mm-40 -94.44 -10.23 33.07 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.564 -179.669 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 120.22 -11.97 10.58 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.573 -0.822 . . . . 0.0 112.522 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 638' ' ' ILE . . . . . 0.456 HG21 ' CE2' ' A' ' 702' ' ' TYR . 5.3 mp -94.25 104.7 16.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 120.668 0.27 . . . . 0.0 111.194 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.42 109.08 15.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.844 0.354 . . . . 0.0 110.994 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 640' ' ' MET . . . . . 0.644 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.4 mtp -119.13 28.89 7.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.891 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -66.68 -31.84 72.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.888 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -72.73 -78.61 0.09 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.878 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 1.3 pp -178.87 126.79 0.26 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.947 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -75.54 131.03 13.26 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.459 2.106 . . . . 0.0 112.274 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 645' ' ' LEU . . . . . 0.445 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.1 tp -126.43 152.47 46.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.206 0.527 . . . . 0.0 111.13 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 646' ' ' ILE . . . . . 0.664 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.2 tt -149.57 133.26 8.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.832 179.174 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 54.15 38.87 62.27 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.239 -0.981 . . . . 0.0 111.93 -179.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.45 7.55 60.97 Favored Glycine 0 CA--C 1.52 0.389 0 C-N-CA 121.085 -0.579 . . . . 0.0 113.626 179.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 11.0 m -133.82 164.15 27.9 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 117.366 0.583 . . . . 0.0 111.557 -179.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 650' ' ' GLU . . . . . 0.445 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.2 OUTLIER -78.92 145.75 33.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.761 179.694 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 651' ' ' LEU . . . . . 0.613 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.94 145.05 47.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.406 -179.745 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -96.9 111.76 23.82 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.984 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 653' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 653' ' ' LEU . 3.8 mm? -53.06 -35.49 59.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.097 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -67.88 -46.19 72.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.231 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 4.7 t -69.15 -38.22 78.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.608 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 656' ' ' PHE . . . . . 0.48 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.3 OUTLIER -68.73 -47.25 66.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.892 179.813 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -60.33 -50.97 71.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.011 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -56.03 -43.44 77.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.102 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . 0.825 HD13 ' CD2' ' A' ' 682' ' ' LEU . 0.2 OUTLIER -57.68 -47.55 82.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.17 -179.782 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 660' ' ' ILE . . . . . 0.695 HG23 HG21 ' A' ' 669' ' ' VAL . 24.7 mt -56.87 -45.09 83.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.8 0.333 . . . . 0.0 110.825 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -62.41 -44.97 95.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.726 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -66.84 -14.13 62.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.251 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . 0.404 ' CE ' ' HB3' ' A' ' 678' ' ' LEU . 0.0 OUTLIER -94.93 36.44 1.2 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.718 0.294 . . . . 0.0 110.979 -179.913 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 68.97 35.65 79.51 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.658 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 84.02 172.46 48.94 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.542 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 666' ' ' MET . . . . . 0.632 ' O ' HG22 ' A' ' 670' ' ' THR . 9.0 tpt -70.99 -28.94 64.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.66 0.267 . . . . 0.0 111.041 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 667' ' ' GLN . . . . . 0.442 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 12.4 pt20 -57.21 -43.74 83.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.25 -179.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 668' ' ' GLN . . . . . 0.431 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -66.63 -52.69 42.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.941 0.4 . . . . 0.0 110.913 179.979 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 669' ' ' VAL . . . . . 0.695 HG21 HG23 ' A' ' 660' ' ' ILE . 53.2 t -49.37 -55.65 3.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.627 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 670' ' ' THR . . . . . 0.632 HG22 ' O ' ' A' ' 666' ' ' MET . 14.9 t -76.39 -48.89 18.26 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 113.857 1.058 . . . . 0.0 113.857 -178.474 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 671' ' ' ASP . . . . . 0.458 ' N ' HG23 ' A' ' 670' ' ' THR . 17.5 t0 -65.65 -51.22 61.25 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -177.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 672' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 8.7 mp -76.92 3.24 12.56 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 -179.154 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 49.22 84.47 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.962 0.41 . . . . 0.0 110.426 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 1.9 ttmt -144.72 21.86 1.63 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.263 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 675' ' ' TRP . . . . . 1.149 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 36.3 m95 -60.26 -28.52 68.13 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.369 0.604 . . . . 0.0 110.089 179.694 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -55.64 -44.51 77.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.643 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 1.7 ttpt -76.85 -51.55 11.09 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 120.704 0.287 . . . . 0.0 111.634 -179.3 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 1.006 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.56 -41.84 73.83 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 179.798 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 679' ' ' ALA . . . . . 0.79 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.48 -34.18 69.94 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-O 120.875 0.369 . . . . 0.0 110.521 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.34 -46.35 69.47 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.389 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 4.9 ttm -65.52 -21.05 66.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.837 179.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 682' ' ' LEU . . . . . 0.825 ' CD2' HD13 ' A' ' 659' ' ' LEU . 2.7 mm? -79.96 -1.4 39.34 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.428 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . 0.795 ' C ' HD12 ' A' ' 684' ' ' ILE . 1.8 mpt_? 72.1 71.85 0.16 Allowed 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.959 0.409 . . . . 0.0 111.37 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . 0.795 HD12 ' C ' ' A' ' 683' ' ' ARG . 3.1 mp -133.57 138.28 30.78 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.328 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . 0.525 ' HD2' HG23 ' A' ' 684' ' ' ILE . 21.7 Cg_endo -61.68 125.3 16.36 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.591 2.194 . . . . 0.0 112.679 -179.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.86 -26.03 64.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.954 179.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.52 -23.84 66.98 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.224 -179.817 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -68.96 109.15 3.8 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.916 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -71.74 -68.93 0.42 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.889 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -51.4 -21.28 2.2 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.771 -179.578 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 691' ' ' ARG . . . . . 0.503 ' NH2' ' HB3' ' A' ' 679' ' ' ALA . 0.0 OUTLIER -49.87 -35.22 22.6 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.881 0.372 . . . . 0.0 110.687 179.677 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . 0.448 HD22 ' NE ' ' A' ' 691' ' ' ARG . 4.5 mm? -70.41 -47.21 61.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.074 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.13 -39.14 69.04 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.451 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 7.1 mttp -61.87 -41.32 97.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.09 0.471 . . . . 0.0 110.255 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 1.149 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.4 OUTLIER -67.32 -43.91 80.46 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.471 179.784 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.443 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 1.3 tt0 -55.24 -46.22 76.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.87 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -77.56 -29.69 52.31 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.074 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 698' ' ' ALA . . . . . 0.42 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.38 -39.25 85.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.544 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 699' ' ' TYR . . . . . 0.528 ' CZ ' ' HE2' ' A' ' 666' ' ' MET . 1.0 OUTLIER -84.99 -32.56 22.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.928 0.394 . . . . 0.0 110.512 179.881 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 700' ' ' CYS . . . . . 0.574 ' HA ' HD23 ' A' ' 704' ' ' LEU . 1.7 m -65.21 -30.28 71.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.714 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -100.91 -1.9 33.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.615 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 702' ' ' TYR . . . . . 0.456 ' CE2' HG21 ' A' ' 638' ' ' ILE . 4.8 m-85 -116.33 -79.59 0.59 Allowed 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 120.813 0.34 . . . . 0.0 111.524 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 1.6 tp -61.52 -40.51 94.89 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.722 -179.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.574 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.4 OUTLIER -48.31 -56.94 6.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.886 0.374 . . . . 0.0 111.429 -179.566 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 12.9 p -54.63 -47.33 73.61 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.383 -179.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 706' ' ' TYR . . . . . 0.63 ' O ' HD22 ' A' ' 709' ' ' LEU . 10.2 t80 -66.13 -29.44 69.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.591 -179.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -96.71 -0.09 48.8 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 6.9 t -116.92 -15.77 10.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.541 0.21 . . . . 0.0 111.523 -179.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 709' ' ' LEU . . . . . 0.63 HD22 ' O ' ' A' ' 706' ' ' TYR . 0.2 OUTLIER -73.96 175.14 7.65 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.751 0.31 . . . . 0.0 110.934 -179.949 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.41 164.51 59.14 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.958 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -66.5 -30.88 43.01 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.604 2.203 . . . . 0.0 111.961 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -48.94 -50.2 36.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.831 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 713' ' ' GLU . . . . . 0.449 ' HB2' ' CD1' ' A' ' 709' ' ' LEU . 3.5 mm-40 -58.26 -29.35 65.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.891 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 714' ' ' HIS . . . . . 0.485 ' CD2' ' CE1' ' A' ' 706' ' ' TYR . 1.8 m170 -75.76 -53.96 7.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.497 179.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 1.9 mtp-105 -60.22 -47.79 84.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.38 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.06 -54.05 40.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.553 -179.369 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . 0.64 HD13 ' HB2' ' A' ' 632' ' ' HIS . 84.8 mt -62.89 -42.38 99.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.128 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 718' ' ' GLU . . . . . 0.633 ' HG3' HD23 ' A' ' 722' ' ' LEU . 28.4 tt0 -67.37 -54.22 22.5 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.502 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -51.04 -33.66 26.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.323 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 720' ' ' GLU . . . . . 0.412 ' O ' ' HG2' ' A' ' 723' ' ' MET . 0.2 OUTLIER -69.42 -55.68 9.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.974 0.416 . . . . 0.0 110.563 179.8 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 721' ' ' VAL . . . . . 0.535 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 23.3 t -63.44 -54.94 26.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.143 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . 0.724 HD13 ' HE2' ' A' ' 725' ' ' LYS . 3.6 mm? -50.36 -43.29 54.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.779 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 723' ' ' MET . . . . . 0.62 ' HB2' HD13 ' A' ' 727' ' ' ILE . 13.4 ptp -72.12 -40.53 68.04 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.079 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 724' ' ' GLU . . . . . 0.429 ' N ' ' HG3' ' A' ' 723' ' ' MET . 2.2 mt-10 -52.41 -37.7 57.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.272 -179.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 725' ' ' LYS . . . . . 0.724 ' HE2' HD13 ' A' ' 722' ' ' LEU . 0.0 OUTLIER -86.05 -45.71 11.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.227 -179.786 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -59.67 -55.75 30.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.199 -179.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 727' ' ' ILE . . . . . 0.642 HG22 ' O ' ' A' ' 727' ' ' ILE . 4.2 mp -88.73 11.76 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.591 -179.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 7.3 tt -48.93 -31.73 7.82 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.757 0.313 . . . . 0.0 111.213 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -61.09 -46.21 91.57 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.858 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 730' ' ' LYS . . . . . 0.463 ' HB2' HG22 ' A' ' 727' ' ' ILE . 1.6 mtpt . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.208 -0.901 . . . . 0.0 110.807 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 619' ' ' TRP . . . . . 0.629 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.135 0 CA-C-O 120.67 0.271 . . . . 0.0 111.347 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 117.84 160.16 11.55 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.45 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -67.08 -33.73 30.81 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.57 2.18 . . . . 0.0 112.081 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 622' ' ' ASN . . . . . 0.441 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 19.5 m-80 -68.13 -34.8 77.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.813 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 623' ' ' VAL . . . . . 0.446 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 56.1 t -71.11 -45.32 72.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.582 179.576 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 624' ' ' GLN . . . . . 0.491 ' HG2' HD11 ' A' ' 722' ' ' LEU . 34.9 tp60 -59.47 -37.84 79.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.42 179.573 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.84 -50.75 69.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.256 179.431 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 9.3 tt -67.78 -28.69 67.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.712 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -72.03 -51.32 22.33 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.09 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.13 -47.85 80.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.935 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 629' ' ' ILE . . . . . 0.494 HG22 ' CD1' ' A' ' 633' ' ' LEU . 38.8 mt -63.63 -37.58 80.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.828 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp -63.88 -47.52 80.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.79 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 5.3 tttm -60.28 -40.1 89.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.875 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 632' ' ' HIS . . . . . 0.852 ' CE1' HD11 ' A' ' 709' ' ' LEU . 73.7 t60 -70.87 -42.82 69.57 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.986 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.598 HD13 ' SD ' ' A' ' 640' ' ' MET . 20.1 mt -57.63 -50.06 74.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.222 -179.692 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 3.3 ptt85 -62.96 -44.12 96.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.817 0.341 . . . . 0.0 110.822 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.69 -11.56 60.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.221 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 636' ' ' GLN . . . . . 0.454 ' CG ' ' CE1' ' A' ' 632' ' ' HIS . 23.4 mm-40 -97.2 -7.84 31.43 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.572 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 111.89 6.75 24.32 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.375 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 638' ' ' ILE . . . . . . . . . . . . . 18.0 mt -117.03 107.86 23.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 CA-C-O 120.679 0.276 . . . . 0.0 111.318 -179.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -82.55 113.61 20.39 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.865 0.364 . . . . 0.0 110.791 179.743 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 640' ' ' MET . . . . . 0.598 ' SD ' HD13 ' A' ' 633' ' ' LEU . 2.0 ttp -124.15 35.45 4.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.883 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -69.53 -31.82 70.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.038 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 642' ' ' GLU . . . . . 0.415 ' O ' HD12 ' A' ' 643' ' ' LEU . 4.6 mm-40 -70.84 -79.01 0.07 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.971 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 643' ' ' LEU . . . . . 0.415 HD12 ' O ' ' A' ' 642' ' ' GLU . 0.1 OUTLIER -178.97 135.02 0.29 Allowed Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.845 179.964 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 644' ' ' PRO . . . . . 0.494 ' HB2' HD11 ' A' ' 651' ' ' LEU . 72.0 Cg_endo -74.69 138.61 24.07 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.523 2.149 . . . . 0.0 112.29 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 645' ' ' LEU . . . . . 0.655 HD12 ' HA ' ' A' ' 650' ' ' GLU . 5.0 tp -131.31 149.96 52.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.171 0.51 . . . . 0.0 111.134 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 646' ' ' ILE . . . . . 0.742 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.2 tt -146.84 131.8 11.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.568 178.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 52.36 44.2 58.23 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.283 -0.961 . . . . 0.0 112.226 -179.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 66.27 8.7 45.65 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 120.925 -0.655 . . . . 0.0 113.773 179.463 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 33.3 m -131.15 161.95 30.99 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 117.374 0.587 . . . . 0.0 111.377 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 650' ' ' GLU . . . . . 0.655 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.6 OUTLIER -80.09 143.53 33.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.768 179.897 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 651' ' ' LEU . . . . . 0.612 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -135.35 145.24 47.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.29 -179.692 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -97.33 110.79 23.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.886 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -52.14 -43.58 64.12 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.128 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 654' ' ' ALA . . . . . 0.441 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -60.89 -43.31 98.63 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.153 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 1.6 t -66.5 -35.5 80.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.803 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 656' ' ' PHE . . . . . 0.499 ' HD2' HD23 ' A' ' 651' ' ' LEU . 0.1 OUTLIER -72.78 -43.61 62.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.938 -179.98 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -59.7 -46.62 88.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.854 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 37.8 mtp180 -63.57 -43.87 95.77 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.048 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . 0.794 HD13 ' CD2' ' A' ' 682' ' ' LEU . 0.2 OUTLIER -59.36 -49.55 77.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.359 -179.67 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 660' ' ' ILE . . . . . 0.569 HD11 ' HH2' ' A' ' 675' ' ' TRP . 41.4 mt -56.83 -45.97 83.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.721 0.296 . . . . 0.0 110.889 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -66.88 -46.24 75.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.163 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -56.32 -21.38 23.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.548 -179.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.86 28.64 1.76 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.627 -0.26 . . . . 0.0 111.31 -179.765 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 90.49 -16.85 56.82 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.78 179.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 135.79 179.43 16.6 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.32 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 666' ' ' MET . . . . . 0.535 ' O ' HG22 ' A' ' 670' ' ' THR . 0.0 OUTLIER -72.64 -40.63 66.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.741 0.305 . . . . 0.0 111.199 -179.954 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 667' ' ' GLN . . . . . 0.404 ' HG2' ' N ' ' A' ' 668' ' ' GLN . 6.6 pm0 -51.13 -43.64 61.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.457 -179.548 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 668' ' ' GLN . . . . . 0.404 ' N ' ' HG2' ' A' ' 667' ' ' GLN . 0.0 OUTLIER -64.8 -52.44 56.82 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.879 0.371 . . . . 0.0 110.925 -179.926 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 669' ' ' VAL . . . . . 0.483 ' HB ' ' HE1' ' A' ' 666' ' ' MET . 89.5 t -49.33 -54.15 6.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.524 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 670' ' ' THR . . . . . 0.535 HG22 ' O ' ' A' ' 666' ' ' MET . 9.6 t -76.18 -54.3 7.01 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -178.563 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 671' ' ' ASP . . . . . 0.503 ' N ' HG23 ' A' ' 670' ' ' THR . 69.7 m-20 -56.88 -51.18 70.09 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -177.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 672' ' ' LEU . . . . . 0.404 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 7.9 mp -77.88 1.62 19.9 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -179.068 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 48.98 83.48 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.951 0.405 . . . . 0.0 110.439 -179.845 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 4.9 mtpm? -144.79 21.51 1.63 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.288 -179.584 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 675' ' ' TRP . . . . . 1.117 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 35.1 m95 -58.34 -29.16 65.72 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 121.338 0.589 . . . . 0.0 110.049 179.654 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 676' ' ' ASN . . . . . 0.414 ' CG ' HD11 ' A' ' 692' ' ' LEU . 13.0 m120 -56.8 -41.27 77.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.676 -179.622 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 9.1 mttt -78.54 -51.95 9.2 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 120.774 0.321 . . . . 0.0 111.565 -179.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 1.012 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -56.77 -40.72 76.33 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 179.404 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 679' ' ' ALA . . . . . 0.796 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.94 -31.84 66.73 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.301 178.746 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.28 -48.18 68.53 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.038 179.379 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -62.04 -23.8 66.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.794 179.397 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 682' ' ' LEU . . . . . 0.794 ' CD2' HD13 ' A' ' 659' ' ' LEU . 3.0 mm? -79.59 -2.42 42.42 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.507 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . 0.775 ' C ' HD12 ' A' ' 684' ' ' ILE . 6.3 mmm180 70.49 72.01 0.21 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.933 0.397 . . . . 0.0 111.443 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . 0.775 HD12 ' C ' ' A' ' 683' ' ' ARG . 2.4 mp -128.52 141.78 42.63 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.456 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . 0.664 ' HD2' HG23 ' A' ' 684' ' ' ILE . 38.1 Cg_endo -68.16 121.33 8.31 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.261 1.974 . . . . 0.0 112.05 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -70.54 -25.08 62.94 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.432 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.37 -18.52 65.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.595 -179.515 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 688' ' ' ALA . . . . . 0.483 ' HB3' ' HB2' ' A' ' 691' ' ' ARG . . . -77.1 111.91 13.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.774 0.321 . . . . 0.0 111.425 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -83.17 -7.6 59.6 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.455 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -97.67 -27.58 14.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.148 0.499 . . . . 0.0 109.926 179.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 691' ' ' ARG . . . . . 0.483 ' HB2' ' HB3' ' A' ' 688' ' ' ALA . 0.3 OUTLIER -52.39 -46.72 66.38 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.32 -179.641 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . 0.451 HD13 ' HA ' ' A' ' 692' ' ' LEU . 3.8 mm? -59.74 -46.2 89.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.299 -179.658 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.42 -39.49 67.87 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.823 0.344 . . . . 0.0 111.411 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.39 -41.93 93.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.453 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 1.117 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 1.1 tp -64.7 -44.67 89.51 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.544 179.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.453 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 2.2 mm-40 -55.55 -47.75 75.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.879 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -76.41 -29.45 57.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.211 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 698' ' ' ALA . . . . . 0.402 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.56 -37.1 82.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.721 -179.648 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 699' ' ' TYR . . . . . 0.493 ' CZ ' ' HE3' ' A' ' 666' ' ' MET . 1.3 p90 -85.38 -36.83 20.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.932 0.396 . . . . 0.0 110.394 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 700' ' ' CYS . . . . . . . . . . . . . 5.3 m -62.77 -30.47 71.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.546 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -95.89 -4.93 42.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.392 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 702' ' ' TYR . . . . . 0.459 ' CD2' HD21 ' A' ' 633' ' ' LEU . 6.8 m-85 -121.56 -75.47 0.59 Allowed 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.838 0.352 . . . . 0.0 111.257 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -54.01 -48.91 69.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.476 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.424 HD23 ' CE1' ' A' ' 699' ' ' TYR . 1.3 mm? -54.9 -29.57 56.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.099 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 24.5 m -69.74 -55.4 10.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.424 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 706' ' ' TYR . . . . . 0.414 ' HA ' HD12 ' A' ' 709' ' ' LEU . 68.8 t80 -62.8 -29.57 70.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.931 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -85.5 -17.48 36.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.317 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 4.4 m -90.73 -21.91 21.35 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.84 0.352 . . . . 0.0 111.05 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 709' ' ' LEU . . . . . 0.852 HD11 ' CE1' ' A' ' 632' ' ' HIS . 60.6 mt -56.53 146.4 25.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.371 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 710' ' ' SER . . . . . 0.439 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.4 OUTLIER -79.39 167.67 32.56 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.607 179.732 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . 0.439 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 9.9 Cg_endo -53.15 -23.06 21.3 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.631 2.221 . . . . 0.0 112.401 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -70.18 -55.21 9.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.852 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 713' ' ' GLU . . . . . 0.562 ' O ' HD12 ' A' ' 717' ' ' LEU . 1.6 mm-40 -63.2 -25.95 68.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.845 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 9.9 m-70 -75.68 -54.69 6.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.116 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -64.9 -38.04 89.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.14 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 33.3 ttt180 -68.19 -54.11 20.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.104 -179.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . 0.596 ' O ' HG23 ' A' ' 721' ' ' VAL . 35.0 mt -64.58 -37.61 88.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.802 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 718' ' ' GLU . . . . . 0.401 ' O ' ' HB2' ' A' ' 722' ' ' LEU . 31.9 tt0 -71.24 -54.24 11.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.557 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 1.5 mmtt -52.4 -32.46 39.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.771 0.319 . . . . 0.0 111.191 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 720' ' ' GLU . . . . . 0.44 ' O ' ' HG2' ' A' ' 723' ' ' MET . 0.5 OUTLIER -70.02 -55.73 8.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.032 0.444 . . . . 0.0 110.468 179.652 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 721' ' ' VAL . . . . . 0.629 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 21.7 t -63.43 -53.49 44.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.183 -179.723 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . 0.491 HD11 ' HG2' ' A' ' 624' ' ' GLN . 1.2 mp -53.12 -41.0 64.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.998 -179.352 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 723' ' ' MET . . . . . 0.575 ' O ' HD12 ' A' ' 727' ' ' ILE . 14.0 ptp -72.0 -38.75 69.6 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.101 179.745 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 40.7 mm-40 -57.33 -33.64 67.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.117 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 725' ' ' LYS . . . . . 0.457 ' HD2' ' CE2' ' A' ' 619' ' ' TRP . 0.0 OUTLIER -86.14 -38.83 17.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.367 -179.704 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -68.41 -50.18 54.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.841 0.353 . . . . 0.0 111.13 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 727' ' ' ILE . . . . . 0.653 HG22 ' O ' ' A' ' 727' ' ' ILE . 4.3 mp -88.2 11.47 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.551 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 3.4 tt -59.49 -35.43 74.11 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.867 0.365 . . . . 0.0 110.906 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -79.86 -71.07 0.47 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.991 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 730' ' ' LYS . . . . . 0.546 ' HG3' HG23 ' A' ' 727' ' ' ILE . 13.1 ptmt . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.917 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 619' ' ' TRP . . . . . 0.614 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.1 OUTLIER . . . . . 0 CA--C 1.528 0.115 0 CA-C-O 120.58 0.228 . . . . 0.0 111.349 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 116.6 160.52 12.07 Favored Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.433 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -68.21 -39.03 10.97 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.541 2.161 . . . . 0.0 112.222 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 10.8 p30 -66.24 -34.22 77.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.885 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 623' ' ' VAL . . . . . 0.445 HG11 ' HB2' ' A' ' 619' ' ' TRP . 44.1 t -68.19 -45.65 82.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.712 179.669 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 624' ' ' GLN . . . . . 0.513 ' HG2' HD11 ' A' ' 722' ' ' LEU . 41.2 tp60 -60.95 -39.61 90.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.543 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 625' ' ' ARG . . . . . 0.484 ' O ' HD12 ' A' ' 629' ' ' ILE . 0.0 OUTLIER -59.52 -50.82 72.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.57 179.702 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 6.7 tt -68.51 -29.71 68.36 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.871 179.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -70.24 -50.27 41.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.373 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.5 -37.1 85.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.346 -179.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 629' ' ' ILE . . . . . 0.523 HD13 ' HB3' ' A' ' 653' ' ' LEU . 38.7 mt -63.86 -54.01 37.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.327 -179.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 630' ' ' LYS . . . . . 0.559 ' HB3' ' HE1' ' A' ' 640' ' ' MET . 0.9 OUTLIER -61.69 -32.41 72.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.269 -179.71 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 631' ' ' LYS . . . . . 0.425 ' N ' ' HG3' ' A' ' 630' ' ' LYS . 1.8 tttm -63.1 -50.96 68.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.84 0.352 . . . . 0.0 111.329 -179.704 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 632' ' ' HIS . . . . . 0.596 ' HB3' HD13 ' A' ' 717' ' ' LEU . 3.5 p-80 -68.31 -39.7 81.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.712 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.463 ' N ' ' CD2' ' A' ' 632' ' ' HIS . 41.8 mt -56.82 -49.84 74.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.144 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 634' ' ' ARG . . . . . 0.468 ' HG3' ' N ' ' A' ' 635' ' ' SER . 11.8 ptt180 -64.08 -39.34 93.85 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.781 0.324 . . . . 0.0 110.615 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 635' ' ' SER . . . . . 0.468 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 75.1 m -73.61 -17.24 61.19 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.011 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 636' ' ' GLN . . . . . 0.679 ' OE1' HD11 ' A' ' 709' ' ' LEU . 0.0 OUTLIER -93.0 -7.17 46.59 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.466 -179.823 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 111.86 3.69 26.53 Favored Glycine 0 C--N 1.331 0.305 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.601 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 638' ' ' ILE . . . . . 0.452 HG21 ' CZ ' ' A' ' 702' ' ' TYR . 17.3 mt -109.66 104.85 17.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-O 120.694 0.283 . . . . 0.0 111.284 -179.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -78.05 129.82 35.7 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.952 0.406 . . . . 0.0 111.061 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 640' ' ' MET . . . . . 0.559 ' HE1' ' HB3' ' A' ' 630' ' ' LYS . 0.2 OUTLIER -129.79 5.59 5.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.466 -179.948 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -58.56 -26.76 63.91 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.742 0.306 . . . . 0.0 111.248 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 642' ' ' GLU . . . . . 0.597 ' O ' HD12 ' A' ' 643' ' ' LEU . 28.9 mt-10 -66.43 -80.8 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.953 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 643' ' ' LEU . . . . . 0.597 HD12 ' O ' ' A' ' 642' ' ' GLU . 0.0 OUTLIER -177.11 118.52 0.26 Allowed Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.901 -179.98 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -65.53 134.49 38.57 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.425 2.083 . . . . 0.0 112.432 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 645' ' ' LEU . . . . . 0.645 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.6 tp -144.06 151.5 39.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.336 0.588 . . . . 0.0 111.441 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 646' ' ' ILE . . . . . 0.557 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.6 tt -149.65 133.49 8.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.228 -0.896 . . . . 0.0 109.705 178.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 52.65 40.73 56.08 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.302 -0.951 . . . . 0.0 112.218 -179.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.35 6.78 58.91 Favored Glycine 0 C--N 1.332 0.361 0 C-N-CA 120.986 -0.626 . . . . 0.0 113.839 179.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 6.3 m -132.08 163.04 29.34 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 117.413 0.606 . . . . 0.0 111.557 -179.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 650' ' ' GLU . . . . . 0.645 ' HA ' HD12 ' A' ' 645' ' ' LEU . 1.0 OUTLIER -78.94 144.27 34.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.727 179.77 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 651' ' ' LEU . . . . . 0.622 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.86 144.99 47.86 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.249 -179.751 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -96.58 110.75 23.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.875 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 653' ' ' LEU . . . . . 0.523 ' HB3' HD13 ' A' ' 629' ' ' ILE . 3.7 mm? -52.14 -32.68 36.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.163 -179.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -70.1 -44.41 69.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.166 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 14.4 t -69.1 -37.35 78.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.925 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 656' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -68.77 -45.9 70.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.884 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -58.36 -49.77 76.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.981 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 1.8 mtt85 -60.04 -42.48 94.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.817 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . 0.809 HD13 HD21 ' A' ' 682' ' ' LEU . 0.0 OUTLIER -57.67 -50.45 73.14 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.307 -179.729 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 660' ' ' ILE . . . . . 0.663 HD12 HD22 ' A' ' 703' ' ' LEU . 17.3 mt -56.71 -45.57 82.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.782 0.325 . . . . 0.0 110.841 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -63.47 -45.97 88.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.739 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -65.27 -19.97 66.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.2 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 8.9 mmm -90.2 36.67 0.88 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.477 -179.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 69.55 40.65 77.96 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.65 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 78.53 174.52 44.23 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.613 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 666' ' ' MET . . . . . 0.582 ' HG2' HG21 ' A' ' 660' ' ' ILE . 0.0 OUTLIER -73.01 -34.66 66.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.803 0.335 . . . . 0.0 111.287 -179.981 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -54.67 -45.7 73.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.434 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 668' ' ' GLN . . . . . 0.482 ' HA ' HD13 ' A' ' 672' ' ' LEU . 0.0 OUTLIER -62.58 -52.37 63.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.955 0.407 . . . . 0.0 110.774 179.943 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 669' ' ' VAL . . . . . 0.514 ' HB ' ' HE2' ' A' ' 666' ' ' MET . 75.1 t -49.21 -55.75 3.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.777 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 670' ' ' THR . . . . . 0.55 HG22 ' O ' ' A' ' 666' ' ' MET . 9.2 t -76.05 -51.65 11.84 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 -178.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 671' ' ' ASP . . . . . 0.496 ' N ' HG23 ' A' ' 670' ' ' THR . 4.0 t70 -60.0 -51.2 70.67 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -177.758 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 672' ' ' LEU . . . . . 0.482 HD13 ' HA ' ' A' ' 668' ' ' GLN . 10.7 mp -77.16 1.19 19.03 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -178.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 11.6 mtpp 49.36 87.21 0.03 OUTLIER 'General case' 0 CA--C 1.521 -0.163 0 CA-C-O 121.133 0.492 . . . . 0.0 110.385 -179.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -150.08 22.07 0.86 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.199 -179.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 675' ' ' TRP . . . . . 1.14 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 36.5 m95 -57.83 -28.49 64.13 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 121.444 0.64 . . . . 0.0 109.988 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 676' ' ' ASN . . . . . 0.403 ' O ' ' HB2' ' A' ' 680' ' ' ASP . 5.0 m-80 -55.18 -42.65 73.5 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.608 -179.672 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.78 -51.64 10.19 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.677 0.275 . . . . 0.0 111.662 -179.337 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 1.018 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -56.46 -40.07 74.25 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.827 -0.435 . . . . 0.0 109.827 179.771 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 679' ' ' ALA . . . . . 0.837 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.56 -35.64 70.67 Favored 'General case' 0 C--N 1.334 -0.079 0 CA-C-O 120.763 0.316 . . . . 0.0 110.567 179.199 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 680' ' ' ASP . . . . . 0.403 ' HB2' ' O ' ' A' ' 676' ' ' ASN . 6.0 t0 -53.03 -47.08 68.64 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.382 179.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 1.8 mtm -65.4 -22.51 66.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.872 179.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 682' ' ' LEU . . . . . 0.809 HD21 HD13 ' A' ' 659' ' ' LEU . 3.5 mm? -78.97 -2.15 38.76 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.576 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . 0.732 ' C ' HD12 ' A' ' 684' ' ' ILE . 3.4 mtp180 71.44 72.03 0.17 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.945 0.402 . . . . 0.0 111.608 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . 0.732 HD12 ' C ' ' A' ' 683' ' ' ARG . 3.2 mp -131.25 140.1 37.49 Favored Pre-proline 0 CA--C 1.532 0.262 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.282 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . 0.61 ' HD2' HG23 ' A' ' 684' ' ' ILE . 32.8 Cg_endo -64.85 123.24 11.35 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.52 2.147 . . . . 0.0 112.756 -179.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.97 -23.29 63.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.954 179.637 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.35 -23.73 67.06 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.272 -179.726 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -72.57 111.63 7.91 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.808 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -70.87 -68.83 0.41 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.952 -179.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -53.74 -15.71 1.37 Allowed 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -179.443 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 691' ' ' ARG . . . . . 0.433 ' NH2' ' HB3' ' A' ' 679' ' ' ALA . 0.0 OUTLIER -51.91 -35.28 44.94 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.79 0.329 . . . . 0.0 110.867 179.83 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . 0.431 HD22 ' N ' ' A' ' 692' ' ' LEU . 3.5 mm? -70.37 -46.85 63.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.938 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.0 -37.85 69.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.236 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 2.9 mmtp -62.61 -39.91 95.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.087 0.47 . . . . 0.0 110.07 179.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 1.14 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.4 OUTLIER -66.8 -44.67 80.62 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.44 179.609 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.47 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 3.0 mt-30 -55.22 -46.17 75.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.757 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -77.23 -29.47 54.14 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.878 179.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 698' ' ' ALA . . . . . 0.418 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -68.94 -39.5 79.53 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.775 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 699' ' ' TYR . . . . . 0.498 ' CZ ' ' HE1' ' A' ' 666' ' ' MET . 0.7 OUTLIER -85.77 -31.33 22.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.937 0.398 . . . . 0.0 110.562 179.971 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 700' ' ' CYS . . . . . 0.57 ' HA ' HD23 ' A' ' 704' ' ' LEU . 8.6 m -68.14 -30.24 69.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.648 179.601 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.0 -1.25 43.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.411 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 702' ' ' TYR . . . . . 0.452 ' CZ ' HG21 ' A' ' 638' ' ' ILE . 6.1 m-85 -118.69 -78.67 0.59 Allowed 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.871 0.367 . . . . 0.0 111.35 -179.739 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 703' ' ' LEU . . . . . 0.663 HD22 HD12 ' A' ' 660' ' ' ILE . 0.4 OUTLIER -59.24 -42.02 90.11 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.712 -179.243 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.57 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.6 OUTLIER -55.21 -41.61 72.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.874 0.369 . . . . 0.0 111.136 -179.71 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.45 -55.87 28.27 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.408 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 706' ' ' TYR . . . . . 0.483 ' HA ' HD12 ' A' ' 709' ' ' LEU . 3.1 t80 -56.34 -47.75 78.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.984 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -66.54 -18.57 65.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.133 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 24.9 p -91.36 -29.38 17.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.802 0.334 . . . . 0.0 110.904 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 709' ' ' LEU . . . . . 0.679 HD11 ' OE1' ' A' ' 636' ' ' GLN . 74.9 mt -61.32 157.56 16.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.902 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -79.11 165.66 47.32 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.711 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -55.52 -22.36 34.58 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.482 2.121 . . . . 0.0 112.172 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -61.87 -54.31 43.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.903 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 713' ' ' GLU . . . . . 0.585 ' HG3' HD22 ' A' ' 709' ' ' LEU . 52.6 mm-40 -60.45 -26.38 66.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.109 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 16.4 m170 -75.98 -54.42 6.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.479 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 715' ' ' ARG . . . . . 0.457 ' HG3' ' N ' ' A' ' 716' ' ' ARG . 0.8 OUTLIER -62.56 -41.33 98.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.464 -179.451 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 716' ' ' ARG . . . . . 0.457 ' N ' ' HG3' ' A' ' 715' ' ' ARG . 0.2 OUTLIER -66.92 -54.0 26.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.844 0.354 . . . . 0.0 111.061 -179.654 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . 0.596 HD13 ' HB3' ' A' ' 632' ' ' HIS . 59.9 mt -63.13 -41.24 99.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.969 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -69.17 -54.3 15.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.552 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.26 -32.35 24.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.167 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 720' ' ' GLU . . . . . 0.446 ' O ' ' HG2' ' A' ' 723' ' ' MET . 1.8 mt-10 -70.17 -55.55 9.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.047 0.451 . . . . 0.0 110.402 179.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 721' ' ' VAL . . . . . 0.614 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 20.0 t -62.59 -53.89 41.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.13 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . 0.513 HD11 ' HG2' ' A' ' 624' ' ' GLN . 1.1 mp -52.93 -41.3 64.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.046 -179.222 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 723' ' ' MET . . . . . 0.591 ' O ' HD12 ' A' ' 727' ' ' ILE . 15.2 ptp -72.97 -40.09 65.59 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.121 179.745 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -57.54 -31.31 65.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.321 -179.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 725' ' ' LYS . . . . . 0.439 ' HD3' ' CE2' ' A' ' 619' ' ' TRP . 3.4 pttp -86.14 -39.83 16.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.402 -179.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -69.86 -51.89 29.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.24 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 727' ' ' ILE . . . . . 0.627 HG22 ' O ' ' A' ' 727' ' ' ILE . 3.9 mp -87.7 11.63 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.733 -179.773 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 3.0 tt -56.27 -42.41 77.39 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.82 0.343 . . . . 0.0 111.007 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -75.22 -54.11 7.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.948 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 1.2 mtmm . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.899 179.98 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 619' ' ' TRP . . . . . 0.468 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.154 0 CA-C-O 120.6 0.238 . . . . 0.0 111.345 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 122.15 159.95 10.79 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.498 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -68.42 -32.68 25.01 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.555 2.17 . . . . 0.0 112.025 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 622' ' ' ASN . . . . . 0.506 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 6.8 p30 -70.74 -33.51 70.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.702 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 623' ' ' VAL . . . . . 0.468 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 57.0 t -76.04 -41.65 38.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.34 179.153 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 624' ' ' GLN . . . . . 0.699 ' CG ' HD11 ' A' ' 722' ' ' LEU . 7.8 tm0? -59.36 -40.45 86.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.253 179.514 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.53 -50.93 63.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.301 179.399 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 626' ' ' LEU . . . . . 0.709 ' O ' HD13 ' A' ' 626' ' ' LEU . 2.8 tm? -57.83 -39.49 77.77 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.653 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 627' ' ' ALA . . . . . 0.455 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -69.09 -52.59 26.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.282 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -56.92 -50.54 72.24 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.235 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 629' ' ' ILE . . . . . 0.599 HG22 HD11 ' A' ' 633' ' ' LEU . 25.6 mt -59.29 -39.53 79.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.153 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 7.0 ttpt -63.8 -49.64 72.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.919 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.32 -40.86 78.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.223 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 632' ' ' HIS . . . . . 0.907 ' CE1' HD11 ' A' ' 709' ' ' LEU . 85.6 t60 -71.67 -40.9 69.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.039 -179.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.745 HD13 ' SD ' ' A' ' 640' ' ' MET . 10.2 mt -56.83 -49.9 74.02 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.147 -179.74 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 1.5 ptt180 -65.71 -40.52 92.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.754 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 66.1 m -73.33 -13.74 61.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.25 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 636' ' ' GLN . . . . . 0.401 ' NE2' ' CE1' ' A' ' 632' ' ' HIS . 0.1 OUTLIER -98.06 -4.74 35.32 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 -179.754 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 109.24 5.84 30.01 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.558 -0.83 . . . . 0.0 112.536 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 638' ' ' ILE . . . . . . . . . . . . . 18.1 mt -113.77 108.96 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-O 120.648 0.261 . . . . 0.0 111.277 -179.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -83.67 107.73 16.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.851 0.358 . . . . 0.0 110.913 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 640' ' ' MET . . . . . 0.745 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.6 ttp -117.09 35.14 4.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.817 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -74.61 -37.75 62.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.157 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -62.02 -82.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.052 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 1.7 pp -177.8 117.43 0.25 Allowed Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.949 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -59.33 150.94 71.55 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.406 2.071 . . . . 0.0 112.241 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 645' ' ' LEU . . . . . 0.692 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.7 tp -144.39 151.4 39.22 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.191 0.52 . . . . 0.0 111.405 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 646' ' ' ILE . . . . . 0.755 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.6 tt -149.81 133.87 8.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.688 178.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 52.57 40.12 54.6 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.34 -0.933 . . . . 0.0 112.282 -179.298 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.58 7.42 61.07 Favored Glycine 0 C--N 1.333 0.404 0 C-N-CA 120.964 -0.636 . . . . 0.0 113.658 179.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.7 m -131.99 162.35 30.92 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 117.346 0.573 . . . . 0.0 111.481 -179.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 650' ' ' GLU . . . . . 0.692 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.9 OUTLIER -77.77 143.84 37.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.825 179.809 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 651' ' ' LEU . . . . . 0.613 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -135.42 145.4 47.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.066 0.46 . . . . 0.0 111.426 -179.588 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -99.18 112.36 24.53 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.754 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 653' ' ' LEU . . . . . 0.403 ' HA ' HD13 ' A' ' 653' ' ' LEU . 3.7 mm? -52.64 -39.06 61.4 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.008 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 654' ' ' ALA . . . . . 0.506 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -64.14 -43.73 94.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.003 179.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 4.2 t -67.57 -39.67 84.91 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.043 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 656' ' ' PHE . . . . . 0.439 ' CE2' ' HG ' ' A' ' 682' ' ' LEU . 0.7 OUTLIER -67.44 -42.74 82.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.708 -179.983 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -59.7 -45.9 90.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.805 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 3.8 mtm180 -63.04 -43.21 99.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.538 179.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . 0.434 HD11 ' CE ' ' A' ' 681' ' ' MET . 0.6 OUTLIER -57.16 -51.45 69.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.966 179.972 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 660' ' ' ILE . . . . . 0.767 HG23 HG21 ' A' ' 669' ' ' VAL . 67.7 mt -57.68 -45.55 86.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.858 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -59.79 -39.69 85.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.82 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -61.15 -21.73 64.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.151 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . 0.429 ' CE ' ' HB3' ' A' ' 678' ' ' LEU . 0.0 OUTLIER -88.47 14.38 9.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.627 -179.769 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 86.11 17.63 60.73 Favored Glycine 0 C--N 1.332 0.358 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.926 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 111.49 169.87 18.79 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.592 -0.813 . . . . 0.0 112.71 179.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 666' ' ' MET . . . . . 0.725 ' HG2' HG21 ' A' ' 660' ' ' ILE . 0.0 OUTLIER -63.83 -31.93 73.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.768 0.318 . . . . 0.0 111.046 -179.972 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -55.6 -48.19 75.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.443 -179.573 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 668' ' ' GLN . . . . . 0.401 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 8.0 mm-40 -62.24 -52.59 63.13 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.842 0.354 . . . . 0.0 111.136 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 669' ' ' VAL . . . . . 0.767 HG21 HG23 ' A' ' 660' ' ' ILE . 60.7 t -50.92 -55.89 5.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.944 -179.649 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 670' ' ' THR . . . . . 0.523 HG23 ' N ' ' A' ' 671' ' ' ASP . 10.8 t -76.17 -53.07 8.82 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 -178.297 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 671' ' ' ASP . . . . . 0.523 ' N ' HG23 ' A' ' 670' ' ' THR . 4.4 t70 -57.32 -51.07 70.86 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -177.722 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 672' ' ' LEU . . . . . 0.401 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 9.1 mp -78.7 2.3 20.07 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -178.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 3.8 mmtp 48.27 86.09 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.076 0.465 . . . . 0.0 110.517 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -149.15 21.68 0.96 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.147 -179.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 675' ' ' TRP . . . . . 1.115 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 31.4 m95 -57.71 -28.4 63.82 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 121.327 0.584 . . . . 0.0 110.145 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -56.07 -42.05 76.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.853 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -77.49 -51.74 10.23 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 120.765 0.316 . . . . 0.0 111.665 -179.261 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 1.036 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -57.27 -40.55 77.96 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.677 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 679' ' ' ALA . . . . . 0.8 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.76 -33.63 68.81 Favored 'General case' 0 C--N 1.334 -0.082 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.412 178.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.16 -49.73 66.03 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.319 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 681' ' ' MET . . . . . 0.434 ' CE ' HD11 ' A' ' 659' ' ' LEU . 4.5 mtm -64.06 -22.37 66.9 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.867 179.366 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 682' ' ' LEU . . . . . 0.44 ' HB3' HD11 ' A' ' 684' ' ' ILE . 2.5 mm? -78.41 -3.34 42.77 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.526 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . 0.71 ' C ' HD12 ' A' ' 684' ' ' ILE . 23.9 mmt85 70.56 71.92 0.2 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.898 0.38 . . . . 0.0 111.546 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . 0.71 HD12 ' C ' ' A' ' 683' ' ' ARG . 2.1 mp -123.0 142.43 38.14 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.158 179.436 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . 0.698 ' HD2' HG23 ' A' ' 684' ' ' ILE . 53.5 Cg_endo -69.86 119.12 6.12 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.499 2.133 . . . . 0.0 112.634 -179.674 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.96 -23.04 63.12 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.045 179.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.23 -22.5 66.88 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.463 -179.635 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 688' ' ' ALA . . . . . 0.759 ' HB3' ' HG2' ' A' ' 691' ' ' ARG . . . -71.84 117.23 13.18 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.928 0.394 . . . . 0.0 111.075 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.25 3.82 29.61 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.37 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -121.69 -13.89 8.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.155 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 691' ' ' ARG . . . . . 0.826 ' HG3' HD22 ' A' ' 692' ' ' LEU . 0.2 OUTLIER -55.0 -35.1 64.0 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.811 0.338 . . . . 0.0 110.933 -179.673 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . 0.826 HD22 ' HG3' ' A' ' 691' ' ' ARG . 3.0 mm? -70.6 -47.69 58.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.042 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.93 -39.58 69.36 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.415 -179.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 3.8 mmtt -64.24 -40.78 96.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.241 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 1.115 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 3.9 tp -63.89 -47.04 82.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.844 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.431 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 0.0 OUTLIER -55.27 -49.09 72.96 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.189 -179.743 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -75.19 -29.49 60.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.126 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -68.54 -38.09 80.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.749 -179.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 699' ' ' TYR . . . . . 0.458 ' CD2' ' CZ2' ' A' ' 675' ' ' TRP . 1.0 OUTLIER -86.47 -30.52 21.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.831 0.348 . . . . 0.0 110.736 -179.877 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 700' ' ' CYS . . . . . . . . . . . . . 15.3 t -69.45 -30.51 68.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.644 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -97.46 -1.37 44.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.472 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 702' ' ' TYR . . . . . 0.593 ' CD2' HD21 ' A' ' 633' ' ' LEU . 7.1 m-85 -121.51 -78.64 0.6 Allowed 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.831 0.348 . . . . 0.0 111.316 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 703' ' ' LEU . . . . . 0.622 ' CD2' HD12 ' A' ' 660' ' ' ILE . 1.1 mp -57.63 -44.55 85.66 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.523 -179.444 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.431 HD23 ' CE1' ' A' ' 699' ' ' TYR . 1.1 mm? -56.4 -49.41 74.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.86 0.362 . . . . 0.0 110.959 -179.801 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . 0.402 ' O ' ' HG ' ' A' ' 709' ' ' LEU . 22.7 m -54.7 -55.29 31.31 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.719 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 706' ' ' TYR . . . . . 0.599 ' HA ' HD12 ' A' ' 709' ' ' LEU . 56.4 t80 -63.77 -29.35 70.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.202 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -79.0 -20.96 47.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.247 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 1.7 m -91.54 -17.59 25.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.283 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 709' ' ' LEU . . . . . 0.907 HD11 ' CE1' ' A' ' 632' ' ' HIS . 78.2 mt -58.62 153.12 17.01 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.914 0.387 . . . . 0.0 111.113 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 710' ' ' SER . . . . . 0.451 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.6 OUTLIER -79.06 168.46 26.78 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.473 179.619 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . 0.451 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 14.4 Cg_endo -56.8 -19.78 32.72 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.518 2.145 . . . . 0.0 112.524 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -67.49 -55.55 13.13 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.038 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 713' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -59.34 -26.17 64.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.075 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -75.83 -54.1 7.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.256 179.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 7.0 mtm180 -63.44 -40.82 98.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.428 -179.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.54 -54.08 27.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.755 0.312 . . . . 0.0 111.241 -179.598 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . 0.635 HD13 ' HB2' ' A' ' 632' ' ' HIS . 57.8 mt -64.85 -39.39 93.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.975 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 718' ' ' GLU . . . . . 0.65 ' HG2' HD22 ' A' ' 722' ' ' LEU . 13.7 tt0 -69.29 -54.2 15.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.561 179.828 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 9.4 mmtt -52.89 -33.33 49.75 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.378 -179.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 720' ' ' GLU . . . . . 0.433 ' O ' ' HG2' ' A' ' 723' ' ' MET . 12.3 mt-10 -69.56 -55.76 9.23 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.079 0.466 . . . . 0.0 110.623 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 721' ' ' VAL . . . . . 0.455 HG11 ' HB1' ' A' ' 627' ' ' ALA . 45.8 t -63.76 -53.33 45.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.15 -179.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . 0.699 HD11 ' CG ' ' A' ' 624' ' ' GLN . 8.0 mp -54.4 -38.77 66.59 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.865 -179.173 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 723' ' ' MET . . . . . 0.499 ' HB2' HD13 ' A' ' 727' ' ' ILE . 13.6 ptp -75.38 -40.61 57.82 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.033 179.605 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -54.32 -40.02 67.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.178 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 725' ' ' LYS . . . . . 0.454 ' HE2' ' CD2' ' A' ' 619' ' ' TRP . 0.0 OUTLIER -85.45 -42.64 14.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.097 -179.86 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -59.51 -53.46 57.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.949 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 727' ' ' ILE . . . . . 0.643 HG22 ' O ' ' A' ' 727' ' ' ILE . 4.2 mp -89.37 11.7 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.551 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 728' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 725' ' ' LYS . 1.7 tt -57.34 -45.56 84.2 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.853 0.359 . . . . 0.0 111.049 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -73.86 -54.71 7.37 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.979 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 6.9 mtmm . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.981 179.998 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 619' ' ' TRP . . . . . 0.442 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.651 0.262 . . . . 0.0 111.284 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 126.11 163.21 11.49 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.491 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -68.52 -37.59 12.66 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.582 2.188 . . . . 0.0 112.241 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -67.35 -38.86 85.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.915 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 623' ' ' VAL . . . . . 0.442 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 40.1 t -70.98 -41.92 76.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.967 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 624' ' ' GLN . . . . . 0.499 ' CG ' HD21 ' A' ' 722' ' ' LEU . 4.0 tm0? -58.6 -45.53 88.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.712 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 74.5 mtt-85 -62.18 -50.63 71.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.708 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 626' ' ' LEU . . . . . 0.599 ' O ' HD23 ' A' ' 626' ' ' LEU . 8.6 tt -61.51 -34.09 74.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.819 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 627' ' ' ALA . . . . . 0.661 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -63.98 -53.76 45.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.185 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -58.97 -42.56 90.25 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.997 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 629' ' ' ILE . . . . . 0.453 HG23 ' HE1' ' A' ' 632' ' ' HIS . 38.3 mt -60.32 -51.39 73.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.048 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 4.7 ttpp -60.79 -32.82 72.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.249 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.67 -48.08 76.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.614 -179.507 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 632' ' ' HIS . . . . . 0.58 ' HB3' HD13 ' A' ' 717' ' ' LEU . 3.3 p-80 -69.47 -39.84 77.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.921 -179.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.512 HD13 ' SD ' ' A' ' 640' ' ' MET . 20.4 mt -55.86 -48.25 75.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.203 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 634' ' ' ARG . . . . . 0.433 ' HG3' ' N ' ' A' ' 635' ' ' SER . 0.1 OUTLIER -67.01 -39.92 87.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.719 0.295 . . . . 0.0 110.814 179.892 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 635' ' ' SER . . . . . 0.433 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 8.5 m -73.75 -14.03 61.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.42 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 636' ' ' GLN . . . . . 0.414 ' HB2' ' O ' ' A' ' 632' ' ' HIS . 0.0 OUTLIER -97.39 -8.26 29.91 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 -179.675 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 118.83 -8.46 12.86 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.583 179.696 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 638' ' ' ILE . . . . . 0.648 ' N ' HD12 ' A' ' 638' ' ' ILE . 3.5 mp -99.5 104.65 16.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.744 0.307 . . . . 0.0 111.03 -179.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 3.2 m -80.57 114.12 19.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.885 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 640' ' ' MET . . . . . 0.512 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.8 ttp -122.6 27.85 7.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.932 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.46 -52.8 59.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.888 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 642' ' ' GLU . . . . . 0.588 ' O ' HD12 ' A' ' 643' ' ' LEU . 0.6 OUTLIER -50.55 -72.39 0.05 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.23 -179.901 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 643' ' ' LEU . . . . . 0.588 HD12 ' O ' ' A' ' 642' ' ' GLU . 0.2 OUTLIER 179.67 134.4 0.25 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.81 179.843 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.13 122.96 7.47 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.455 2.103 . . . . 0.0 112.343 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 645' ' ' LEU . . . . . 0.612 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.9 tp -125.73 153.39 44.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.305 0.574 . . . . 0.0 111.319 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 646' ' ' ILE . . . . . 0.554 HD11 ' HA ' ' A' ' 695' ' ' LEU . 2.2 tt -149.62 133.17 7.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.448 179.156 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 50.59 43.61 45.97 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.246 -0.978 . . . . 0.0 112.138 -179.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 68.58 6.19 48.31 Favored Glycine 0 CA--C 1.52 0.378 0 C-N-CA 121.127 -0.559 . . . . 0.0 113.991 179.304 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 4.0 m -131.27 162.79 29.24 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 117.68 0.74 . . . . 0.0 111.696 -178.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 650' ' ' GLU . . . . . 0.612 ' HA ' HD12 ' A' ' 645' ' ' LEU . 2.5 mp0 -81.25 142.42 33.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.743 179.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 651' ' ' LEU . . . . . 0.644 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.11 144.76 48.78 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.071 0.462 . . . . 0.0 111.099 179.891 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.88 109.43 21.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.926 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -52.21 -42.62 63.69 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.083 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -62.78 -46.34 88.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.272 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 40.4 t -67.69 -37.58 82.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.911 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 656' ' ' PHE . . . . . 0.464 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.2 OUTLIER -68.82 -44.39 73.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.981 -179.898 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -59.96 -46.35 89.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.004 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.14 -43.89 98.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.009 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . 0.546 HD13 HD21 ' A' ' 682' ' ' LEU . 0.1 OUTLIER -56.7 -45.1 82.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.401 -179.65 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 660' ' ' ILE . . . . . 0.742 HG23 HG21 ' A' ' 669' ' ' VAL . 37.2 mt -62.97 -44.47 99.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.264 -179.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -64.3 -45.2 89.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.641 -179.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . 0.441 ' HG2' ' HA ' ' A' ' 659' ' ' LEU . 18.3 pt-20 -66.36 -14.15 61.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.598 -179.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.67 34.7 1.45 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.803 0.335 . . . . 0.0 111.199 -179.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 73.89 32.86 58.41 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.827 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 85.54 172.59 49.07 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.606 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 666' ' ' MET . . . . . 0.679 ' O ' HG22 ' A' ' 670' ' ' THR . 10.1 tpt -72.15 -28.87 63.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.643 0.259 . . . . 0.0 111.237 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -55.07 -48.29 73.72 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.106 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 668' ' ' GLN . . . . . 0.4 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -63.0 -51.86 65.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.856 0.36 . . . . 0.0 110.812 179.949 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 669' ' ' VAL . . . . . 0.742 HG21 HG23 ' A' ' 660' ' ' ILE . 40.7 t -49.19 -55.31 4.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.722 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 670' ' ' THR . . . . . 0.679 HG22 ' O ' ' A' ' 666' ' ' MET . 9.7 t -76.02 -50.69 14.12 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -178.372 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 671' ' ' ASP . . . . . 0.471 ' N ' HG23 ' A' ' 670' ' ' THR . 40.0 m-20 -62.14 -51.27 68.55 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -177.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 672' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 4.4 mm? -78.0 3.55 14.47 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -179.16 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 1.7 mttt 49.07 86.43 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.996 0.427 . . . . 0.0 110.477 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 27.7 mttt -144.88 22.21 1.59 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.229 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 675' ' ' TRP . . . . . 1.116 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 36.6 m95 -61.21 -30.34 70.37 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 121.409 0.624 . . . . 0.0 110.173 179.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -57.02 -43.29 81.69 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.372 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.18 -51.52 11.96 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.802 0.334 . . . . 0.0 111.243 -179.615 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.973 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.84 -40.29 72.62 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.572 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 679' ' ' ALA . . . . . 0.835 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.6 -33.68 69.23 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.551 179.107 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -53.77 -49.51 68.09 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.363 179.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 5.4 mtp -62.73 -22.21 66.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.763 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 682' ' ' LEU . . . . . 0.546 HD21 HD13 ' A' ' 659' ' ' LEU . 3.2 mm? -79.28 -1.13 35.22 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.457 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . 0.776 ' C ' HD12 ' A' ' 684' ' ' ILE . 0.0 OUTLIER 70.63 71.93 0.2 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.956 0.408 . . . . 0.0 111.343 179.98 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . 0.776 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.8 mp -124.43 136.99 28.45 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.682 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . 0.431 ' HD2' HG23 ' A' ' 684' ' ' ILE . 36.8 Cg_endo -65.99 125.2 13.75 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.474 2.116 . . . . 0.0 112.361 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.85 -13.94 62.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.393 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.3 -23.18 66.95 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.734 0.302 . . . . 0.0 111.207 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 688' ' ' ALA . . . . . 0.422 ' HB1' ' HG3' ' A' ' 691' ' ' ARG . . . -82.81 107.6 15.55 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.949 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -75.09 -68.33 0.56 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.206 -179.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 70.8 m-20 -54.6 -17.36 3.21 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.811 -179.696 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 691' ' ' ARG . . . . . 0.425 ' NH1' HG13 ' A' ' 684' ' ' ILE . 0.0 OUTLIER -45.93 -40.51 10.31 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.876 0.369 . . . . 0.0 111.299 179.859 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -59.69 -42.06 92.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.056 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.23 -37.23 69.21 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.892 0.377 . . . . 0.0 111.159 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -65.11 -42.96 93.47 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.29 179.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 1.116 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.4 OUTLIER -63.98 -43.91 94.31 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.422 179.67 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.445 ' O ' ' CD1' ' A' ' 699' ' ' TYR . 5.1 tp60 -56.17 -44.82 79.71 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.643 179.76 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -77.22 -29.8 54.32 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.176 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 698' ' ' ALA . . . . . 0.445 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.39 -37.53 83.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.729 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 699' ' ' TYR . . . . . 0.541 ' CZ ' ' HE2' ' A' ' 666' ' ' MET . 2.1 p90 -84.92 -37.62 20.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.969 0.414 . . . . 0.0 110.232 179.646 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 700' ' ' CYS . . . . . 0.642 ' HA ' HD23 ' A' ' 704' ' ' LEU . 15.3 t -60.88 -30.32 70.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.646 179.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -100.09 -0.42 39.06 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.453 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 702' ' ' TYR . . . . . 0.452 ' CZ ' HG21 ' A' ' 638' ' ' ILE . 5.1 m-85 -117.69 -79.05 0.59 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.78 0.324 . . . . 0.0 111.623 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 5.9 mp -64.41 -40.35 95.61 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.951 -179.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.642 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.4 OUTLIER -47.44 -56.63 6.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.806 0.336 . . . . 0.0 111.515 -179.593 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.28 -46.12 72.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.251 -179.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 706' ' ' TYR . . . . . 0.573 ' O ' HD22 ' A' ' 709' ' ' LEU . 10.2 t80 -61.95 -29.47 70.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.135 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -95.45 -4.46 45.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.497 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 8.6 p -112.52 -23.19 10.41 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.613 0.244 . . . . 0.0 111.378 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 709' ' ' LEU . . . . . 0.642 HD21 ' CD2' ' A' ' 714' ' ' HIS . 0.2 OUTLIER -70.15 172.61 7.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.812 0.339 . . . . 0.0 110.938 -179.942 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.6 165.57 51.86 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.098 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -68.42 -22.69 38.8 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.633 2.222 . . . . 0.0 112.191 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -52.3 -51.09 60.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.853 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 713' ' ' GLU . . . . . 0.552 ' HB2' HD11 ' A' ' 709' ' ' LEU . 1.6 mm-40 -57.96 -27.13 63.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.149 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 714' ' ' HIS . . . . . 0.642 ' CD2' HD21 ' A' ' 709' ' ' LEU . 24.8 m-70 -76.03 -53.8 7.81 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.669 179.61 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.53 -46.61 88.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.56 -179.44 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 716' ' ' ARG . . . . . 0.4 ' CG ' ' N ' ' A' ' 717' ' ' LEU . 4.7 ptt180 -67.54 -51.57 49.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.797 -179.188 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . 0.58 HD13 ' HB3' ' A' ' 632' ' ' HIS . 90.8 mt -64.57 -43.61 93.32 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.693 0.282 . . . . 0.0 111.072 -179.57 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 718' ' ' GLU . . . . . 0.62 ' HG3' HD23 ' A' ' 722' ' ' LEU . 10.8 tt0 -65.75 -54.17 30.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.242 179.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -50.46 -35.62 29.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.373 -179.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 720' ' ' GLU . . . . . 0.436 ' O ' ' HG2' ' A' ' 723' ' ' MET . 9.9 mt-10 -70.8 -55.47 8.49 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.933 0.397 . . . . 0.0 110.992 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 721' ' ' VAL . . . . . 0.661 HG11 ' HB1' ' A' ' 627' ' ' ALA . 22.0 t -63.63 -55.17 24.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.168 -179.487 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . 0.62 HD23 ' HG3' ' A' ' 718' ' ' GLU . 3.7 mm? -53.38 -42.37 66.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.999 -179.272 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 723' ' ' MET . . . . . 0.579 ' O ' HD12 ' A' ' 727' ' ' ILE . 14.1 ptp -68.66 -38.82 80.71 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 120.38 -0.528 . . . . 0.0 109.98 179.563 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -57.77 -35.02 70.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.157 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 725' ' ' LYS . . . . . 0.436 ' HD2' ' CE2' ' A' ' 619' ' ' TRP . 0.7 OUTLIER -86.11 -34.69 20.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.497 -179.654 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 726' ' ' GLU . . . . . 0.416 ' N ' ' HG3' ' A' ' 725' ' ' LYS . 10.3 mt-10 -72.37 -51.67 19.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.901 0.381 . . . . 0.0 111.189 -179.64 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 727' ' ' ILE . . . . . 0.632 HG22 ' O ' ' A' ' 727' ' ' ILE . 4.2 mp -87.55 11.68 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.647 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 8.5 tp -55.23 -56.22 22.43 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.775 0.322 . . . . 0.0 111.261 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -56.92 -49.05 76.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.266 -179.603 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.324 -0.846 . . . . 0.0 110.905 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 619' ' ' TRP . . . . . 0.607 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.164 0 CA-C-O 120.584 0.23 . . . . 0.0 111.464 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 118.22 166.45 13.74 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.49 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.31 -39.84 5.05 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.501 2.134 . . . . 0.0 112.363 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 622' ' ' ASN . . . . . 0.459 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 29.5 m-80 -63.78 -36.87 85.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.952 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 623' ' ' VAL . . . . . 0.46 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 48.6 t -68.64 -45.56 81.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.884 179.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 624' ' ' GLN . . . . . 0.561 ' HG2' HD21 ' A' ' 722' ' ' LEU . 27.7 tp60 -59.65 -36.92 77.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.527 179.713 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 625' ' ' ARG . . . . . 0.433 ' HD3' ' CE2' ' A' ' 657' ' ' PHE . 0.1 OUTLIER -63.36 -50.79 68.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.509 179.694 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 6.3 tt -67.16 -27.5 67.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.921 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -73.47 -42.97 61.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.287 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.02 -34.92 73.9 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.176 -179.802 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 19.5 mt -68.94 -49.11 66.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.323 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.86 -35.8 81.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.932 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 631' ' ' LYS . . . . . 0.41 ' O ' ' HG2' ' A' ' 634' ' ' ARG . 0.1 OUTLIER -64.52 -44.08 92.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.993 0.425 . . . . 0.0 110.702 179.775 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 632' ' ' HIS . . . . . 0.458 ' CG ' HD11 ' A' ' 709' ' ' LEU . 35.7 t60 -69.64 -41.63 75.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.806 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.414 ' CD2' ' CD2' ' A' ' 702' ' ' TYR . 42.6 mt -57.14 -49.93 74.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.145 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 634' ' ' ARG . . . . . 0.41 ' HG2' ' O ' ' A' ' 631' ' ' LYS . 0.0 OUTLIER -62.32 -43.5 98.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.709 179.793 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.58 -14.1 61.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.33 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -96.5 -8.18 32.76 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 111.649 0.241 . . . . 0.0 111.649 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 115.13 0.43 22.46 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.52 179.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 638' ' ' ILE . . . . . 0.566 HG21 ' CZ ' ' A' ' 702' ' ' TYR . 14.7 mt -109.41 104.93 17.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 120.766 0.317 . . . . 0.0 111.192 -179.494 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 1.3 m -83.28 104.14 13.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.048 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 640' ' ' MET . . . . . 0.405 ' HE2' HD12 ' A' ' 633' ' ' LEU . 0.0 OUTLIER -98.28 25.96 5.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.818 179.854 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -78.06 -33.11 51.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.812 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -59.49 -73.4 0.09 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.84 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 179.13 118.41 0.21 Allowed Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.877 179.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.76 127.75 16.76 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.364 2.042 . . . . 0.0 111.967 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 645' ' ' LEU . . . . . 0.629 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.3 tp -142.68 152.54 42.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.407 0.623 . . . . 0.0 111.836 -179.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 646' ' ' ILE . . . . . 0.517 HD11 ' HA ' ' A' ' 695' ' ' LEU . 3.0 tt -149.86 133.53 8.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.552 178.772 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 51.59 41.75 50.25 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.223 -0.989 . . . . 0.0 112.222 -179.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.22 5.61 54.58 Favored Glycine 0 CA--C 1.521 0.466 0 C-N-CA 121.065 -0.588 . . . . 0.0 113.971 179.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.8 m -130.89 162.36 29.83 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 117.561 0.681 . . . . 0.0 111.66 -179.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 650' ' ' GLU . . . . . 0.629 ' HA ' HD12 ' A' ' 645' ' ' LEU . 1.6 mp0 -79.2 144.21 34.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.787 179.763 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 651' ' ' LEU . . . . . 0.635 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -135.25 144.98 47.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.098 0.475 . . . . 0.0 111.433 -179.737 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.71 111.15 23.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.821 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -52.23 -43.41 64.27 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.146 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 654' ' ' ALA . . . . . 0.459 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -59.25 -45.6 90.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.206 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 37.2 t -68.9 -33.9 74.53 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.756 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 656' ' ' PHE . . . . . 0.456 ' CE1' ' HB2' ' A' ' 651' ' ' LEU . 0.8 OUTLIER -68.54 -46.2 70.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.006 179.966 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 657' ' ' PHE . . . . . 0.433 ' CE2' ' HD3' ' A' ' 625' ' ' ARG . 75.7 t80 -60.82 -48.55 81.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.137 -179.816 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.13 -45.52 87.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.262 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . 0.847 HD13 ' CD2' ' A' ' 682' ' ' LEU . 0.1 OUTLIER -57.44 -51.0 71.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.547 -179.498 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 660' ' ' ILE . . . . . 0.734 HG23 HG21 ' A' ' 669' ' ' VAL . 53.3 mt -56.75 -44.54 81.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.751 0.31 . . . . 0.0 110.831 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -62.6 -45.13 94.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.786 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -64.48 -14.99 59.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.355 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 1.7 mmm -94.21 28.06 2.64 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.704 0.288 . . . . 0.0 111.214 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 76.03 33.94 48.68 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.641 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 87.23 171.91 47.71 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.535 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 666' ' ' MET . . . . . 0.575 ' O ' HG22 ' A' ' 670' ' ' THR . 10.7 tpt -70.73 -26.48 63.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.699 0.285 . . . . 0.0 111.218 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 667' ' ' GLN . . . . . 0.417 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 20.0 pt20 -58.3 -46.49 86.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.067 -179.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 668' ' ' GLN . . . . . 0.588 ' HA ' HD13 ' A' ' 672' ' ' LEU . 7.3 mm-40 -64.9 -52.75 54.77 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.901 0.382 . . . . 0.0 110.971 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 669' ' ' VAL . . . . . 0.734 HG21 HG23 ' A' ' 660' ' ' ILE . 47.5 t -49.13 -55.89 3.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.816 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 670' ' ' THR . . . . . 0.575 HG22 ' O ' ' A' ' 666' ' ' MET . 12.6 t -76.23 -47.3 24.44 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -178.394 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 671' ' ' ASP . . . . . 0.44 ' N ' HG23 ' A' ' 670' ' ' THR . 15.4 t0 -66.54 -51.14 59.76 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -177.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 672' ' ' LEU . . . . . 0.588 HD13 ' HA ' ' A' ' 668' ' ' GLN . 7.9 mp -76.08 1.93 14.24 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -179.08 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 6.1 tttp 49.87 84.2 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.024 0.44 . . . . 0.0 110.614 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.02 21.63 1.41 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.026 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 675' ' ' TRP . . . . . 1.112 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 31.1 m95 -59.16 -31.7 69.22 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.324 0.583 . . . . 0.0 110.219 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -54.56 -42.97 71.61 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.785 -179.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.97 -51.49 11.05 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 120.706 0.289 . . . . 0.0 111.565 -179.327 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 1.008 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.72 -42.52 75.41 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.813 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 679' ' ' ALA . . . . . 0.75 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.64 -33.15 68.68 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 120.84 0.352 . . . . 0.0 110.589 179.037 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.23 -49.32 67.05 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.532 179.601 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 7.0 mtm -64.08 -21.12 66.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.856 179.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 682' ' ' LEU . . . . . 0.847 ' CD2' HD13 ' A' ' 659' ' ' LEU . 2.9 mm? -78.96 -1.7 36.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.399 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . 0.809 ' C ' HD12 ' A' ' 684' ' ' ILE . 13.5 mmm180 73.17 71.7 0.13 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 121.0 0.428 . . . . 0.0 111.39 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . 0.809 HD12 ' C ' ' A' ' 683' ' ' ARG . 2.7 mp -131.72 140.35 38.01 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.135 179.557 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . 0.634 ' HD2' HG23 ' A' ' 684' ' ' ILE . 34.7 Cg_endo -65.1 123.09 11.06 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.518 2.145 . . . . 0.0 112.68 -179.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.79 -26.2 64.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.96 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 3.1 p -65.36 -21.6 66.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.095 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -71.8 111.08 6.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.871 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 25.7 mm-40 -71.67 -68.92 0.42 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.093 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -52.94 -19.21 2.42 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.909 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 691' ' ' ARG . . . . . 0.502 ' HD2' HG22 ' A' ' 684' ' ' ILE . 0.0 OUTLIER -53.4 -34.69 58.68 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.75 0.31 . . . . 0.0 110.726 179.753 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -70.33 -52.94 19.01 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.175 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -69.36 -36.48 76.9 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.357 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 2.0 tmmm? -63.81 -41.28 97.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.135 0.493 . . . . 0.0 110.003 179.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 1.112 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.7 OUTLIER -63.37 -44.92 93.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.421 179.533 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.42 ' O ' ' CD1' ' A' ' 699' ' ' TYR . 43.2 mt-30 -55.53 -44.82 77.06 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.744 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -77.34 -29.78 53.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.206 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 698' ' ' ALA . . . . . 0.409 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.12 -39.05 86.57 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.62 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 699' ' ' TYR . . . . . 0.492 ' CE2' ' HE2' ' A' ' 666' ' ' MET . 1.7 p90 -83.77 -37.49 22.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.017 0.437 . . . . 0.0 110.244 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 700' ' ' CYS . . . . . 0.503 ' HA ' HD23 ' A' ' 704' ' ' LEU . 1.3 m -59.95 -31.71 70.12 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.485 179.708 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.53 -11.06 32.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.223 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 702' ' ' TYR . . . . . 0.566 ' CZ ' HG21 ' A' ' 638' ' ' ILE . 4.0 m-85 -114.44 -76.56 0.58 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.9 0.381 . . . . 0.0 111.405 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -54.66 -49.85 69.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.733 -179.361 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.503 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.5 OUTLIER -49.61 -45.45 48.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.851 0.357 . . . . 0.0 111.353 -179.607 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 2.3 m -55.38 -55.27 33.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.731 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 706' ' ' TYR . . . . . 0.478 ' HA ' HD12 ' A' ' 709' ' ' LEU . 71.5 t80 -64.59 -30.42 71.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.018 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -78.6 -18.62 54.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.423 -179.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 1.7 t -93.13 -19.89 21.04 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.785 0.326 . . . . 0.0 110.97 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 709' ' ' LEU . . . . . 0.741 HD22 ' CB ' ' A' ' 713' ' ' GLU . 49.6 mt -51.48 141.51 15.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.555 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 710' ' ' SER . . . . . 0.439 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.5 OUTLIER -78.03 167.97 31.39 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.5 179.586 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . 0.439 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 9.2 Cg_endo -52.58 -22.91 18.05 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.517 2.145 . . . . 0.0 112.374 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -75.98 -55.89 5.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.982 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 713' ' ' GLU . . . . . 0.741 ' CB ' HD22 ' A' ' 709' ' ' LEU . 2.3 mm-40 -58.54 -27.26 64.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.021 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 8.7 m-70 -75.85 -53.96 7.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.432 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.05 -36.48 83.72 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.148 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.43 -54.36 21.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.827 0.346 . . . . 0.0 111.089 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . 0.414 ' O ' HG23 ' A' ' 721' ' ' VAL . 83.6 mt -64.42 -40.62 96.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.712 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 718' ' ' GLU . . . . . 0.557 ' HG3' HD23 ' A' ' 722' ' ' LEU . 24.4 tt0 -67.33 -54.03 24.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.398 179.631 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt -50.72 -35.01 29.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.315 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 720' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' A' ' 723' ' ' MET . 10.4 mt-10 -67.77 -55.61 12.4 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.993 0.425 . . . . 0.0 110.544 179.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 721' ' ' VAL . . . . . 0.607 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 33.2 t -63.75 -54.73 28.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.106 -179.691 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . 0.764 HD13 ' HE2' ' A' ' 725' ' ' LYS . 0.8 OUTLIER -49.06 -44.03 41.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.874 -179.31 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 723' ' ' MET . . . . . 0.537 ' HB2' HD13 ' A' ' 727' ' ' ILE . 16.9 ptp -72.77 -39.9 66.4 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.15 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -50.86 -41.83 58.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.64 -179.305 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 725' ' ' LYS . . . . . 0.764 ' HE2' HD13 ' A' ' 722' ' ' LEU . 0.0 OUTLIER -86.08 -36.82 19.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.686 0.279 . . . . 0.0 111.315 -179.751 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -62.48 -53.61 52.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.989 0.423 . . . . 0.0 110.945 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 727' ' ' ILE . . . . . 0.655 HG22 ' O ' ' A' ' 727' ' ' ILE . 4.6 mp -88.49 11.57 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.552 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 8.7 tt -56.79 -34.17 67.38 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.774 0.321 . . . . 0.0 110.995 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -90.53 -48.32 7.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.938 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 22.6 mtmt . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.852 -179.966 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 619' ' ' TRP . . . . . 0.553 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.462 0.151 0 CA-C-O 120.674 0.273 . . . . 0.0 111.297 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 123.55 164.96 12.17 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.329 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -65.64 -40.8 16.56 Favored 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 122.453 2.102 . . . . 0.0 112.191 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -59.85 -43.25 94.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.918 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 623' ' ' VAL . . . . . 0.452 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 38.3 t -71.54 -38.05 66.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.913 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 624' ' ' GLN . . . . . 0.669 ' CG ' HD11 ' A' ' 722' ' ' LEU . 3.2 tm0? -54.3 -45.39 72.54 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.661 179.787 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 8.3 mtt180 -70.68 -39.77 73.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.343 179.423 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 626' ' ' LEU . . . . . 0.8 ' O ' HD13 ' A' ' 626' ' ' LEU . 3.1 tm? -63.28 -32.27 73.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.768 179.663 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 627' ' ' ALA . . . . . 0.496 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -72.9 -48.26 38.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.319 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -57.03 -46.56 82.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.951 -179.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 629' ' ' ILE . . . . . 0.428 HG22 ' CD1' ' A' ' 633' ' ' LEU . 10.4 mt -66.38 -38.95 82.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.929 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 15.5 ttpt -64.22 -39.52 94.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.935 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.13 -42.41 89.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.817 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 632' ' ' HIS . . . . . 0.866 ' CE1' HD11 ' A' ' 709' ' ' LEU . 84.1 t60 -70.52 -41.44 72.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.796 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.428 ' CD1' HG22 ' A' ' 629' ' ' ILE . 49.7 mt -58.27 -49.73 76.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.291 -179.718 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 634' ' ' ARG . . . . . 0.442 ' HG3' ' N ' ' A' ' 635' ' ' SER . 3.8 ptt180 -65.79 -38.77 89.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.983 -179.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 635' ' ' SER . . . . . 0.442 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 0.3 OUTLIER -73.71 -20.38 60.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.091 179.77 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 636' ' ' GLN . . . . . 0.423 ' CG ' ' CE1' ' A' ' 632' ' ' HIS . 32.4 mm-40 -88.93 -5.25 58.11 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.665 -179.661 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 109.97 -0.85 30.09 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.418 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 638' ' ' ILE . . . . . 0.511 HG21 ' CE2' ' A' ' 702' ' ' TYR . 13.9 mt -103.21 104.62 16.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 CA-C-O 120.703 0.287 . . . . 0.0 111.127 -179.612 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.11 108.43 17.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.899 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 1.6 mtp -119.87 28.6 8.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.864 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -60.99 -33.0 72.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.835 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -67.48 -78.62 0.06 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.904 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 643' ' ' LEU . . . . . 0.488 HD13 ' OE2' ' A' ' 650' ' ' GLU . 0.7 OUTLIER 178.06 129.81 0.21 Allowed Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.901 179.888 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 644' ' ' PRO . . . . . 0.466 ' HB2' HD11 ' A' ' 651' ' ' LEU . 57.1 Cg_endo -70.98 130.86 18.49 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.413 2.075 . . . . 0.0 112.223 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 645' ' ' LEU . . . . . 0.62 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.4 tp -124.12 151.78 43.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.272 0.558 . . . . 0.0 111.455 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 646' ' ' ILE . . . . . 0.548 HG22 ' HB3' ' A' ' 651' ' ' LEU . 0.8 OUTLIER -149.66 132.9 7.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.614 178.982 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.21 40.95 60.69 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.304 -179.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.08 5.43 58.54 Favored Glycine 0 C--N 1.334 0.439 0 C-N-CA 120.989 -0.624 . . . . 0.0 113.875 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -132.26 163.79 27.83 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 117.447 0.624 . . . . 0.0 111.432 -179.115 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 650' ' ' GLU . . . . . 0.62 ' HA ' HD12 ' A' ' 645' ' ' LEU . 3.6 mt-10 -79.29 145.74 33.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.822 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 651' ' ' LEU . . . . . 0.584 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -135.69 145.05 46.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.11 0.481 . . . . 0.0 111.599 -179.57 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.91 112.33 24.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.97 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 6.7 mp -61.08 -33.78 73.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.076 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -64.58 -47.57 78.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.935 0.398 . . . . 0.0 110.942 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 53.3 t -70.34 -33.07 71.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.271 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 656' ' ' PHE . . . . . 0.47 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.3 OUTLIER -69.1 -46.28 68.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.569 179.624 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -58.17 -52.76 64.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.091 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -57.84 -41.34 82.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.823 0.344 . . . . 0.0 110.789 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . 0.572 HD21 ' CE ' ' A' ' 681' ' ' MET . 0.2 OUTLIER -55.03 -46.0 75.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.124 179.93 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 660' ' ' ILE . . . . . 0.708 HD11 ' CH2' ' A' ' 675' ' ' TRP . 12.6 mt -63.2 -42.33 96.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.045 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -62.21 -46.15 90.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.114 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 71.4 tt0 -72.86 -9.54 58.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.474 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 1.4 mmm -95.03 36.66 1.19 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.765 0.317 . . . . 0.0 111.125 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 66.91 38.43 92.89 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.364 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 79.96 172.23 43.76 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.453 -179.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 666' ' ' MET . . . . . 0.792 ' O ' HG22 ' A' ' 670' ' ' THR . 9.7 tpt -72.15 -27.19 62.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.654 0.264 . . . . 0.0 111.256 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -57.53 -48.85 78.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.437 -179.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 668' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -63.19 -42.87 99.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.837 0.351 . . . . 0.0 111.296 -179.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 669' ' ' VAL . . . . . 0.651 HG12 ' CD1' ' A' ' 675' ' ' TRP . 40.2 t -61.81 -53.35 49.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.785 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 670' ' ' THR . . . . . 0.792 HG22 ' O ' ' A' ' 666' ' ' MET . 10.1 t -75.75 -49.66 17.53 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -178.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 671' ' ' ASP . . . . . 0.436 ' N ' HG23 ' A' ' 670' ' ' THR . 51.2 m-20 -63.09 -51.01 68.28 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -178.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 22.6 mt -87.04 10.87 15.17 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 111.895 0.332 . . . . 0.0 111.895 -179.362 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 10.5 ttpp 46.67 77.19 0.09 Allowed 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 120.929 0.395 . . . . 0.0 110.506 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.52 6.71 14.74 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.706 -179.371 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 675' ' ' TRP . . . . . 0.795 ' HA ' HD22 ' A' ' 678' ' ' LEU . 77.1 m95 -65.05 -22.73 67.02 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.7 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -59.16 -51.68 68.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.845 0.355 . . . . 0.0 111.022 -179.519 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 5.1 tptt -78.0 -47.18 19.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.167 0.508 . . . . 0.0 110.193 179.402 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.795 HD22 ' HA ' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -52.97 -46.41 68.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.176 179.297 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 679' ' ' ALA . . . . . 0.655 ' O ' HD13 ' A' ' 684' ' ' ILE . . . -71.27 -35.68 71.45 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.213 179.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -52.87 -48.08 67.37 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.778 0.323 . . . . 0.0 110.863 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 681' ' ' MET . . . . . 0.572 ' CE ' HD21 ' A' ' 659' ' ' LEU . 1.8 ttp -65.3 -20.69 66.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.861 179.527 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 682' ' ' LEU . . . . . 0.467 ' HG ' ' CE2' ' A' ' 656' ' ' PHE . 2.1 mm? -80.06 -3.43 48.54 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.523 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . 0.808 ' C ' HD12 ' A' ' 684' ' ' ILE . 0.5 OUTLIER 74.89 71.72 0.1 Allowed 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.936 0.398 . . . . 0.0 111.318 179.874 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . 0.808 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.8 mp -125.13 138.1 30.98 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.21 179.631 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . 0.505 ' HD2' HG23 ' A' ' 684' ' ' ILE . 41.1 Cg_endo -68.42 121.32 8.26 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.364 2.043 . . . . 0.0 112.567 -179.654 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 686' ' ' LYS . . . . . 0.571 ' NZ ' HG23 ' A' ' 687' ' ' THR . 3.0 pptp? -69.76 -18.71 63.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.184 179.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 687' ' ' THR . . . . . 0.571 HG23 ' NZ ' ' A' ' 686' ' ' LYS . 0.2 OUTLIER -65.23 -20.47 66.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.299 -179.766 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 688' ' ' ALA . . . . . 0.761 ' HB3' ' HG2' ' A' ' 691' ' ' ARG . . . -65.02 117.65 7.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.899 0.381 . . . . 0.0 110.87 179.778 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.13 7.83 14.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.557 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -138.84 -0.19 1.93 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.442 179.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 691' ' ' ARG . . . . . 0.761 ' HG2' ' HB3' ' A' ' 688' ' ' ALA . 2.5 ptt180 -56.48 -33.94 66.45 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.764 0.316 . . . . 0.0 111.068 -179.585 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . 0.707 ' O ' HD23 ' A' ' 695' ' ' LEU . 0.5 OUTLIER -70.17 -53.09 18.67 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.927 0.394 . . . . 0.0 110.996 -179.943 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.98 -37.18 69.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.828 0.346 . . . . 0.0 111.565 -179.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.44 -41.29 98.67 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.361 -179.495 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 0.713 HD11 ' HB3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -72.95 -40.01 65.73 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.969 -0.293 . . . . 0.0 110.654 179.972 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.509 ' N ' HD23 ' A' ' 695' ' ' LEU . 0.0 OUTLIER -55.33 -44.6 76.02 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.29 0.567 . . . . 0.0 109.752 179.126 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -77.6 -29.46 51.92 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.754 179.075 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 698' ' ' ALA . . . . . 0.415 ' HB3' ' HA ' ' A' ' 695' ' ' LEU . . . -66.78 -40.68 88.26 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.878 -179.647 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 699' ' ' TYR . . . . . 0.558 ' CE2' HD23 ' A' ' 704' ' ' LEU . 2.6 p90 -80.82 -40.4 25.02 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.833 0.349 . . . . 0.0 110.441 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 700' ' ' CYS . . . . . 0.439 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 0.7 OUTLIER -58.86 -33.03 70.0 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.784 179.909 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -94.4 -4.57 48.17 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.68 -179.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 702' ' ' TYR . . . . . 0.511 ' CE2' HG21 ' A' ' 638' ' ' ILE . 8.3 m-85 -123.3 -76.58 0.59 Allowed 'General case' 0 C--O 1.231 0.126 0 CA-C-O 120.791 0.329 . . . . 0.0 111.38 -179.786 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 703' ' ' LEU . . . . . 0.433 HD13 HD12 ' A' ' 660' ' ' ILE . 25.5 mt -56.31 -45.95 80.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.488 -179.356 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.558 HD23 ' CE2' ' A' ' 699' ' ' TYR . 0.4 OUTLIER -47.62 -54.34 12.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.956 0.407 . . . . 0.0 111.284 -179.792 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . 0.415 ' O ' ' HG ' ' A' ' 709' ' ' LEU . 0.1 OUTLIER -54.57 -48.34 72.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.97 -179.846 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 706' ' ' TYR . . . . . 0.524 ' HA ' HD12 ' A' ' 709' ' ' LEU . 46.6 t80 -64.51 -31.61 72.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.052 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -79.57 -16.28 56.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.306 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -97.44 -19.75 18.22 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.771 0.319 . . . . 0.0 111.13 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 709' ' ' LEU . . . . . 0.866 HD11 ' CE1' ' A' ' 632' ' ' HIS . 45.7 mt -55.31 151.36 9.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.998 0.428 . . . . 0.0 111.466 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 710' ' ' SER . . . . . 0.429 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.3 OUTLIER -80.05 171.73 11.66 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.597 179.753 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . 0.429 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 60.1 Cg_endo -72.38 -6.75 19.67 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.494 2.129 . . . . 0.0 112.862 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -74.57 -56.62 4.63 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.854 0.359 . . . . 0.0 110.943 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 713' ' ' GLU . . . . . 0.741 ' OE1' HD13 ' A' ' 709' ' ' LEU . 2.8 pp20? -61.06 -25.79 67.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.033 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -73.23 -54.1 9.26 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.167 179.571 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 26.5 ttt180 -60.13 -40.69 90.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.11 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.47 -53.94 12.28 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.324 -179.702 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . 0.566 HD12 ' OE1' ' A' ' 713' ' ' GLU . 76.8 mt -60.6 -43.26 97.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.863 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 718' ' ' GLU . . . . . 0.724 ' HG3' HD13 ' A' ' 722' ' ' LEU . 36.3 tt0 -63.86 -54.03 41.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.361 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 10.8 mmtt -50.38 -35.07 26.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.292 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 720' ' ' GLU . . . . . 0.44 ' O ' ' HG2' ' A' ' 723' ' ' MET . 1.5 mm-40 -70.39 -55.31 9.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.981 0.419 . . . . 0.0 110.93 179.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 721' ' ' VAL . . . . . 0.553 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 39.2 t -63.77 -55.15 24.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.179 -179.568 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . 0.724 HD13 ' HG3' ' A' ' 718' ' ' GLU . 7.1 mp -53.48 -41.94 66.75 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.1 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 723' ' ' MET . . . . . 0.59 ' O ' HD12 ' A' ' 727' ' ' ILE . 5.8 ptp -68.92 -38.83 79.79 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.052 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 724' ' ' GLU . . . . . 0.405 ' N ' ' HG3' ' A' ' 723' ' ' MET . 2.0 mt-10 -59.68 -35.38 74.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.145 -179.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 725' ' ' LYS . . . . . 0.447 ' HD3' ' CE2' ' A' ' 619' ' ' TRP . 10.0 pttt -86.15 -37.8 18.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.433 -179.663 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 726' ' ' GLU . . . . . 0.405 ' N ' ' HG3' ' A' ' 725' ' ' LYS . 3.5 mm-40 -70.11 -50.42 40.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.308 -179.524 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 727' ' ' ILE . . . . . 0.647 HG22 ' O ' ' A' ' 727' ' ' ILE . 4.1 mp -88.09 11.64 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.697 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 2.8 tt -57.68 -35.73 70.97 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.835 0.35 . . . . 0.0 110.952 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -63.04 -51.52 66.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.994 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 3.6 mtpt . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.18 -0.914 . . . . 0.0 110.927 -179.941 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 619' ' ' TRP . . . . . 0.551 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.462 0.172 0 CA-C-O 120.705 0.288 . . . . 0.0 111.275 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 126.99 169.49 12.72 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.424 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -69.19 -33.65 18.27 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.589 2.193 . . . . 0.0 112.195 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 622' ' ' ASN . . . . . 0.556 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 46.6 m-80 -68.25 -43.34 78.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.849 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 623' ' ' VAL . . . . . 0.492 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 38.6 t -71.85 -39.58 67.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.897 179.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 624' ' ' GLN . . . . . 0.64 ' CG ' HD11 ' A' ' 722' ' ' LEU . 1.9 tm0? -56.55 -50.39 72.03 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.868 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 625' ' ' ARG . . . . . 0.437 ' NH2' HD11 ' A' ' 629' ' ' ILE . 6.9 mmm180 -64.44 -43.39 94.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.769 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 626' ' ' LEU . . . . . 0.619 ' O ' HD23 ' A' ' 626' ' ' LEU . 4.1 tt -59.65 -36.93 77.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.046 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 627' ' ' ALA . . . . . 0.41 ' CB ' HG11 ' A' ' 721' ' ' VAL . . . -72.36 -45.8 58.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.365 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.1 -47.11 81.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.167 -179.77 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 629' ' ' ILE . . . . . 0.437 HD11 ' NH2' ' A' ' 625' ' ' ARG . 8.5 mt -65.74 -42.49 92.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.098 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.75 -45.16 91.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.169 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 2.1 tttp -59.8 -43.86 94.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.19 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 632' ' ' HIS . . . . . 0.704 ' HB2' HD13 ' A' ' 717' ' ' LEU . 86.3 t60 -68.91 -40.89 78.86 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.119 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.455 HD12 ' CE ' ' A' ' 640' ' ' MET . 46.2 mt -57.49 -47.46 81.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.171 -179.737 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -64.14 -43.25 95.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.827 0.346 . . . . 0.0 110.605 179.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 20.2 m -73.67 -11.74 60.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.303 179.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 636' ' ' GLN . . . . . 0.403 ' HG3' ' NE2' ' A' ' 632' ' ' HIS . 32.2 mm-40 -97.46 -9.6 26.93 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.654 -179.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 118.57 -8.7 13.25 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.268 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 638' ' ' ILE . . . . . 0.502 HG21 ' CZ ' ' A' ' 702' ' ' TYR . 10.4 mt -100.57 104.64 16.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.649 0.261 . . . . 0.0 111.001 -179.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.82 109.49 15.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.086 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 640' ' ' MET . . . . . 0.455 ' CE ' HD12 ' A' ' 633' ' ' LEU . 1.6 mtm -113.64 25.15 11.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.82 179.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.98 -47.76 49.82 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.865 -179.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 642' ' ' GLU . . . . . 0.773 ' O ' HD12 ' A' ' 643' ' ' LEU . 0.2 OUTLIER -49.59 -72.6 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.096 -179.938 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 643' ' ' LEU . . . . . 0.773 HD12 ' O ' ' A' ' 642' ' ' GLU . 0.0 OUTLIER -178.05 117.66 0.25 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.821 179.86 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -67.97 119.82 6.83 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.393 2.062 . . . . 0.0 112.097 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 645' ' ' LEU . . . . . 0.516 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.4 tp -131.15 154.96 47.8 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.402 0.62 . . . . 0.0 111.651 -179.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 646' ' ' ILE . . . . . 0.559 HD11 ' HA ' ' A' ' 695' ' ' LEU . 2.3 tt -149.94 134.2 8.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.54 178.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 50.14 41.65 38.9 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.214 -0.993 . . . . 0.0 112.12 -179.343 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.16 5.74 54.74 Favored Glycine 0 CA--C 1.522 0.507 0 C-N-CA 121.025 -0.607 . . . . 0.0 113.812 179.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -131.82 162.54 30.32 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 117.553 0.677 . . . . 0.0 111.541 -179.089 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 650' ' ' GLU . . . . . 0.516 ' HA ' HD12 ' A' ' 645' ' ' LEU . 5.2 mt-10 -81.38 144.33 31.52 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.85 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 651' ' ' LEU . . . . . 0.617 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.78 145.07 48.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.191 179.988 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -95.27 110.41 22.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.883 -179.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 653' ' ' LEU . . . . . 0.444 HD22 ' CD2' ' A' ' 651' ' ' LEU . 4.0 mm? -52.85 -36.07 58.35 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.025 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 654' ' ' ALA . . . . . 0.556 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -69.31 -47.09 65.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.042 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 19.3 t -65.91 -41.78 91.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.629 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 656' ' ' PHE . . . . . 0.423 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.1 OUTLIER -67.37 -44.13 79.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.739 179.805 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -56.52 -51.71 67.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.885 179.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 11.2 ttt180 -58.58 -40.85 84.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.773 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . 0.49 HD12 ' HB2' ' A' ' 678' ' ' LEU . 0.2 OUTLIER -55.61 -45.62 77.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.102 -179.947 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 660' ' ' ILE . . . . . 0.715 HG23 HG21 ' A' ' 669' ' ' VAL . 33.0 mt -66.11 -44.27 91.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.265 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -61.25 -41.51 97.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.386 -179.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -72.3 -10.34 59.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.61 -179.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.74 36.58 1.38 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.76 0.314 . . . . 0.0 111.186 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 68.63 28.81 72.91 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.628 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 92.32 171.37 41.26 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.593 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 666' ' ' MET . . . . . 0.575 ' SD ' HG21 ' A' ' 660' ' ' ILE . 10.6 tpt -71.59 -30.87 66.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.758 0.313 . . . . 0.0 111.254 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -55.15 -44.92 75.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.139 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 668' ' ' GLN . . . . . 0.417 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -65.23 -52.19 56.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.898 0.38 . . . . 0.0 110.942 179.922 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 669' ' ' VAL . . . . . 0.715 HG21 HG23 ' A' ' 660' ' ' ILE . 48.7 t -49.02 -54.75 4.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.592 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 670' ' ' THR . . . . . 0.565 HG22 ' O ' ' A' ' 666' ' ' MET . 12.9 t -76.22 -50.68 13.83 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 -178.59 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 671' ' ' ASP . . . . . 0.473 ' N ' HG23 ' A' ' 670' ' ' THR . 70.0 m-20 -61.18 -51.18 70.09 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -177.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 672' ' ' LEU . . . . . 0.417 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 10.4 mp -76.22 1.62 15.42 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -178.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 2.9 mmmt 50.14 85.19 0.03 OUTLIER 'General case' 0 C--O 1.232 0.138 0 CA-C-O 121.042 0.448 . . . . 0.0 110.387 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 7.4 mtmt -147.88 19.88 1.14 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.209 -179.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 675' ' ' TRP . . . . . 1.146 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 26.4 m95 -55.77 -29.24 59.31 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-O 121.428 0.632 . . . . 0.0 110.199 179.816 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -57.34 -42.9 82.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.684 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 11.1 mmtp -76.32 -51.83 11.18 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 111.668 0.248 . . . . 0.0 111.668 -179.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 1.046 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -57.32 -41.3 79.68 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 179.528 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 679' ' ' ALA . . . . . 0.782 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.72 -30.01 65.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.208 178.779 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.44 -51.56 66.53 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.295 179.57 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -60.53 -22.5 63.68 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.644 179.405 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 682' ' ' LEU . . . . . 0.413 ' HB2' ' O ' ' A' ' 679' ' ' ALA . 2.5 mm? -78.89 -2.2 38.74 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.445 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . 0.739 ' C ' HD12 ' A' ' 684' ' ' ILE . 1.1 mmt180 71.88 71.85 0.16 Allowed 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.962 0.41 . . . . 0.0 110.867 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . 0.739 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.7 mp -122.56 135.76 25.96 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.927 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.29 122.59 10.11 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.418 2.078 . . . . 0.0 112.3 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 1.5 mmtm -70.0 -17.28 63.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.245 179.804 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 1.1 p -65.46 -22.81 66.79 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.321 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 688' ' ' ALA . . . . . 0.471 ' HB1' ' HG3' ' A' ' 691' ' ' ARG . . . -84.58 105.18 15.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.871 0.367 . . . . 0.0 110.905 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 -70.49 -68.46 0.43 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.181 -179.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -52.76 -19.55 2.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.871 -179.583 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 691' ' ' ARG . . . . . 0.471 ' HG3' ' HB1' ' A' ' 688' ' ' ALA . 0.0 OUTLIER -48.09 -37.1 14.45 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.856 0.36 . . . . 0.0 111.171 179.922 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -64.23 -42.97 96.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.006 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.05 -36.78 69.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.971 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 3.5 tttt -65.67 -41.69 92.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.128 179.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 1.146 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.2 OUTLIER -64.59 -41.93 95.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.279 179.51 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.461 ' O ' ' CD1' ' A' ' 699' ' ' TYR . 0.0 OUTLIER -57.85 -44.16 86.36 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.663 179.706 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -77.37 -29.79 53.47 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.128 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 698' ' ' ALA . . . . . 0.437 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.39 -37.68 83.49 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.716 -179.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 699' ' ' TYR . . . . . 0.549 ' CZ ' ' HE2' ' A' ' 666' ' ' MET . 2.1 p90 -84.26 -39.06 19.73 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.945 0.402 . . . . 0.0 110.305 179.689 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 700' ' ' CYS . . . . . 0.446 ' HA ' HD23 ' A' ' 704' ' ' LEU . 13.7 t -60.03 -30.54 69.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.567 179.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -97.89 -3.49 38.49 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.451 179.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 702' ' ' TYR . . . . . 0.502 ' CZ ' HG21 ' A' ' 638' ' ' ILE . 5.3 m-85 -117.98 -74.94 0.59 Allowed 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.862 0.363 . . . . 0.0 111.278 -179.719 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 703' ' ' LEU . . . . . 0.598 ' CD2' HD12 ' A' ' 660' ' ' ILE . 1.1 mp -60.91 -46.8 89.21 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.677 -179.263 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.447 HD23 ' CE2' ' A' ' 699' ' ' TYR . 0.7 OUTLIER -52.76 -50.76 62.86 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.925 0.393 . . . . 0.0 111.072 -179.812 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . 0.565 ' O ' HD13 ' A' ' 709' ' ' LEU . 0.3 OUTLIER -54.6 -54.84 36.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.719 179.935 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 706' ' ' TYR . . . . . 0.497 ' CE2' ' CE1' ' A' ' 714' ' ' HIS . 23.8 t80 -47.18 -43.12 20.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.97 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -93.79 -0.82 55.67 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.246 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.06 -16.43 56.8 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.453 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 709' ' ' LEU . . . . . 0.583 ' H ' HD13 ' A' ' 709' ' ' LEU . 0.0 OUTLIER -95.71 -173.35 2.84 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.833 0.349 . . . . 0.0 111.51 -179.642 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 710' ' ' SER . . . . . 0.416 ' O ' HD23 ' A' ' 709' ' ' LEU . 0.3 OUTLIER -86.71 165.47 32.35 Favored Pre-proline 0 C--N 1.332 -0.158 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.192 -179.705 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . 0.402 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 14.5 Cg_endo -56.87 -18.78 28.93 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.772 2.315 . . . . 0.0 112.972 -179.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -60.04 -54.16 49.24 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.93 0.395 . . . . 0.0 110.81 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 713' ' ' GLU . . . . . 0.455 ' HB2' ' HG ' ' A' ' 709' ' ' LEU . 2.7 mm-40 -61.28 -25.93 67.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.932 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 714' ' ' HIS . . . . . 0.497 ' CE1' ' CE2' ' A' ' 706' ' ' TYR . 0.2 OUTLIER -75.59 -54.06 7.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.254 179.529 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 22.5 ttt85 -66.22 -34.12 77.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.202 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 3.0 ttt180 -67.79 -54.28 20.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.841 0.353 . . . . 0.0 110.983 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . 0.704 HD13 ' HB2' ' A' ' 632' ' ' HIS . 29.7 mt -64.62 -34.98 79.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.449 179.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 718' ' ' GLU . . . . . 0.62 ' HG3' HD13 ' A' ' 722' ' ' LEU . 28.3 tt0 -69.81 -53.81 16.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.405 179.599 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.48 -33.41 54.19 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.562 -179.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 720' ' ' GLU . . . . . 0.452 ' O ' ' HG2' ' A' ' 723' ' ' MET . 13.8 mt-10 -70.56 -55.73 8.18 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.036 0.446 . . . . 0.0 110.498 179.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 721' ' ' VAL . . . . . 0.551 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 41.4 t -61.66 -51.58 71.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.013 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . 0.64 HD11 ' CG ' ' A' ' 624' ' ' GLN . 9.0 mp -56.47 -38.56 71.87 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.921 -179.188 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 723' ' ' MET . . . . . 0.605 ' O ' HD12 ' A' ' 727' ' ' ILE . 16.1 ptp -74.67 -41.34 60.46 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.954 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 724' ' ' GLU . . . . . 0.432 ' N ' ' HG3' ' A' ' 723' ' ' MET . 1.6 mm-40 -56.87 -30.65 64.06 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.156 -179.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 725' ' ' LYS . . . . . 0.447 ' HD3' ' CZ2' ' A' ' 619' ' ' TRP . 15.0 pttt -86.19 -43.52 12.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.256 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -66.38 -51.55 55.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.082 -179.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 727' ' ' ILE . . . . . 0.632 HG22 ' O ' ' A' ' 727' ' ' ILE . 3.9 mp -87.83 11.66 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.667 -179.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 5.4 tt -52.64 -34.0 49.4 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.829 0.347 . . . . 0.0 111.142 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -83.57 -55.59 4.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.891 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 27.3 mtmm . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.27 -0.871 . . . . 0.0 110.932 -179.961 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 619' ' ' TRP . . . . . 0.507 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.1 OUTLIER . . . . . 0 CA--C 1.528 0.132 0 CA-C-O 120.618 0.246 . . . . 0.0 111.443 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 119.93 161.72 11.65 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.385 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -68.22 -36.19 17.16 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.499 2.133 . . . . 0.0 112.264 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 622' ' ' ASN . . . . . 0.48 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 43.1 m-80 -67.56 -35.86 79.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.856 179.904 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 623' ' ' VAL . . . . . 0.436 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 40.6 t -70.44 -38.48 74.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.618 179.527 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 624' ' ' GLN . . . . . 0.558 ' HG2' HD21 ' A' ' 722' ' ' LEU . 24.6 tp60 -68.17 -34.76 76.9 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.332 179.518 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 625' ' ' ARG . . . . . 0.517 ' O ' HD12 ' A' ' 629' ' ' ILE . 0.1 OUTLIER -63.21 -50.71 69.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.33 179.511 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 8.5 tt -67.35 -33.52 75.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.711 179.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -69.09 -46.87 66.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.209 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -59.07 -49.18 78.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.073 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 629' ' ' ILE . . . . . 0.716 HG21 HD23 ' A' ' 653' ' ' LEU . 7.3 mt -62.97 -35.46 71.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.109 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 5.7 ttpt -63.21 -47.85 80.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.069 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.31 -39.25 92.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.08 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 632' ' ' HIS . . . . . 0.791 ' HB2' HD13 ' A' ' 717' ' ' LEU . 78.5 t60 -70.73 -42.58 70.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.161 -179.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.587 HD13 ' SD ' ' A' ' 640' ' ' MET . 15.4 mt -58.13 -50.07 74.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.349 -179.559 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.62 -42.36 98.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.796 0.331 . . . . 0.0 110.671 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -73.59 -11.5 60.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.066 179.457 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 636' ' ' GLN . . . . . 0.4 ' CG ' ' CE1' ' A' ' 632' ' ' HIS . 15.6 mm-40 -98.62 -9.32 24.93 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.573 -179.799 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 119.06 -9.04 12.28 Favored Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.467 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 638' ' ' ILE . . . . . 0.648 ' N ' HD12 ' A' ' 638' ' ' ILE . 3.5 mp -100.69 104.65 16.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.748 0.309 . . . . 0.0 111.112 -179.62 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 2.4 m -76.68 113.44 14.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.89 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 640' ' ' MET . . . . . 0.587 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.9 mtp -129.09 31.7 4.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.97 -179.862 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.55 -28.53 69.93 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.043 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 642' ' ' GLU . . . . . 0.475 ' O ' HD12 ' A' ' 643' ' ' LEU . 27.4 mt-10 -79.86 -80.13 0.13 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.041 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 643' ' ' LEU . . . . . 0.475 HD12 ' O ' ' A' ' 642' ' ' GLU . 0.0 OUTLIER -177.54 140.14 0.43 Allowed Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.876 -179.972 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 644' ' ' PRO . . . . . 0.46 ' HB2' HD11 ' A' ' 651' ' ' LEU . 72.4 Cg_endo -77.02 147.36 26.61 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.588 2.192 . . . . 0.0 112.481 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 645' ' ' LEU . . . . . 0.65 HD12 ' HA ' ' A' ' 650' ' ' GLU . 5.1 tp -136.04 150.51 49.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.131 0.491 . . . . 0.0 110.965 179.675 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 646' ' ' ILE . . . . . 0.767 HD11 ' HA ' ' A' ' 695' ' ' LEU . 0.6 OUTLIER -147.85 132.19 9.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.701 179.249 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.31 41.79 62.86 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.317 -0.944 . . . . 0.0 112.345 -179.367 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 69.52 7.49 58.09 Favored Glycine 0 C--N 1.332 0.348 0 C-N-CA 121.0 -0.619 . . . . 0.0 113.779 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.7 m -132.97 163.76 28.48 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 117.358 0.579 . . . . 0.0 111.434 -179.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 650' ' ' GLU . . . . . 0.65 ' HA ' HD12 ' A' ' 645' ' ' LEU . 1.1 mp0 -79.66 144.54 33.65 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.708 179.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 651' ' ' LEU . . . . . 0.603 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -135.11 144.93 47.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.125 0.488 . . . . 0.0 111.357 -179.661 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.9 107.26 19.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.856 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 653' ' ' LEU . . . . . 0.716 HD23 HG21 ' A' ' 629' ' ' ILE . 7.2 mp -55.03 -40.21 69.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.959 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 654' ' ' ALA . . . . . 0.48 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -59.19 -43.45 92.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.98 179.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 5.6 t -72.16 -43.03 65.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.613 179.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 656' ' ' PHE . . . . . 0.435 ' CE2' ' HG ' ' A' ' 682' ' ' LEU . 0.3 OUTLIER -60.45 -46.37 90.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.754 179.801 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -60.6 -49.5 77.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.936 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.1 -43.22 99.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.946 -179.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . 0.469 HD22 ' O ' ' A' ' 678' ' ' LEU . 0.2 OUTLIER -57.55 -39.85 77.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.161 -179.87 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 660' ' ' ILE . . . . . 0.746 HD11 ' CH2' ' A' ' 675' ' ' TRP . 83.1 mt -69.01 -43.71 81.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.785 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.35 -43.35 94.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.051 -179.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -69.81 -13.73 62.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.355 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 1.2 ttm -94.27 21.18 7.24 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.29 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 95.44 -2.77 65.45 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.61 -0.805 . . . . 0.0 113.124 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 116.06 178.47 18.26 Favored Glycine 0 C--N 1.332 0.314 0 C-N-CA 120.539 -0.839 . . . . 0.0 112.446 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 666' ' ' MET . . . . . 0.705 ' HG2' HG21 ' A' ' 660' ' ' ILE . 0.0 OUTLIER -71.55 -30.85 66.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.862 0.363 . . . . 0.0 110.911 179.896 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 667' ' ' GLN . . . . . 0.401 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 19.0 pt20 -57.79 -48.74 78.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.458 -179.725 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 668' ' ' GLN . . . . . 0.415 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 8.9 mm-40 -62.37 -52.41 63.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.864 0.364 . . . . 0.0 111.334 -179.637 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 669' ' ' VAL . . . . . 0.613 HG21 HG23 ' A' ' 660' ' ' ILE . 73.4 t -51.4 -55.78 7.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.936 -179.646 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 670' ' ' THR . . . . . 0.526 HG22 ' O ' ' A' ' 666' ' ' MET . 8.0 t -76.09 -50.03 15.83 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 -178.099 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 671' ' ' ASP . . . . . 0.477 ' N ' HG23 ' A' ' 670' ' ' THR . 5.7 t70 -61.6 -51.15 69.72 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -177.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 672' ' ' LEU . . . . . 0.415 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 8.8 mp -78.59 2.7 18.42 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 -178.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 48.77 86.6 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.994 0.426 . . . . 0.0 110.485 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -149.15 21.75 0.96 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.077 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 675' ' ' TRP . . . . . 1.072 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 36.2 m95 -59.02 -27.98 65.98 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.447 0.641 . . . . 0.0 110.093 179.706 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -56.54 -42.79 79.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.542 -179.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.58 -51.62 11.28 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.784 0.326 . . . . 0.0 111.419 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.972 HD22 ' HA ' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.49 -39.73 70.8 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 179.693 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 679' ' ' ALA . . . . . 0.845 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.94 -34.65 69.2 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.507 179.154 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -53.24 -48.5 68.16 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.433 179.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.14 -21.42 66.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.769 179.37 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 682' ' ' LEU . . . . . 0.541 HD23 ' O ' ' A' ' 678' ' ' LEU . 3.6 mm? -78.9 -1.41 35.0 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.496 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . 0.675 ' C ' HD12 ' A' ' 684' ' ' ILE . 3.5 mpt_? 68.5 71.81 0.29 Allowed 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.94 0.4 . . . . 0.0 111.489 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . 0.675 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.9 mp -123.97 136.02 26.99 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.273 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -63.25 125.33 15.52 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.418 2.079 . . . . 0.0 112.414 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.77 -16.05 63.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.102 179.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.57 -23.95 66.97 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.216 -179.787 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 688' ' ' ALA . . . . . 0.471 ' HB1' ' HB3' ' A' ' 691' ' ' ARG . . . -77.84 115.68 17.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.859 0.361 . . . . 0.0 110.769 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -76.18 -68.24 0.6 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.376 -179.456 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 56.9 m-20 -57.76 -11.67 2.41 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 691' ' ' ARG . . . . . 0.484 ' CG ' HD22 ' A' ' 692' ' ' LEU . 4.9 ptt-85 -50.32 -32.44 17.12 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.791 0.329 . . . . 0.0 111.049 -179.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . 0.484 HD22 ' CG ' ' A' ' 691' ' ' ARG . 2.9 mm? -68.17 -50.39 54.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.925 -179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.03 -37.31 69.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.039 179.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 694' ' ' LYS . . . . . 0.408 ' O ' ' HB2' ' A' ' 698' ' ' ALA . 1.3 mtpt -63.28 -37.83 88.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.243 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 1.072 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.5 OUTLIER -68.77 -44.26 74.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.484 179.74 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.449 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 31.8 tt0 -55.37 -47.7 75.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.748 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 71.1 mt-10 -77.11 -29.61 54.91 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.834 179.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 698' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' A' ' 694' ' ' LYS . . . -66.46 -38.03 86.44 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.46 -179.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 699' ' ' TYR . . . . . 0.499 ' CD2' ' CZ2' ' A' ' 675' ' ' TRP . 1.0 OUTLIER -85.92 -30.53 22.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.893 0.378 . . . . 0.0 110.496 179.862 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 700' ' ' CYS . . . . . 0.467 ' HA ' HD23 ' A' ' 704' ' ' LEU . 15.4 t -66.84 -30.51 70.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.644 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -99.49 -2.32 36.24 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.478 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 702' ' ' TYR . . . . . 0.405 ' CD1' ' O ' ' A' ' 698' ' ' ALA . 6.2 m-85 -117.68 -78.27 0.58 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.802 0.334 . . . . 0.0 111.214 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 75.7 mt -57.71 -43.74 85.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.464 -179.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.467 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.6 OUTLIER -55.08 -52.22 63.89 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.881 0.372 . . . . 0.0 111.008 -179.921 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . 0.601 ' O ' HD13 ' A' ' 709' ' ' LEU . 59.7 p -54.37 -55.0 32.98 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.665 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 706' ' ' TYR . . . . . 0.442 ' HA ' ' CD2' ' A' ' 632' ' ' HIS . 9.7 t80 -46.9 -43.07 18.57 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.845 -179.571 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -94.03 0.02 55.72 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -179.48 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 22.6 t -79.19 -18.47 52.94 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -179.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 709' ' ' LEU . . . . . 0.601 HD13 ' O ' ' A' ' 705' ' ' SER . 0.0 OUTLIER -94.16 -173.92 3.23 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.831 0.348 . . . . 0.0 111.406 -179.815 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 710' ' ' SER . . . . . 0.407 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.3 OUTLIER -85.45 165.97 33.0 Favored Pre-proline 0 C--N 1.332 -0.181 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.048 -179.804 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . 0.407 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 18.0 Cg_endo -57.89 -18.93 37.12 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.625 2.217 . . . . 0.0 112.734 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -60.91 -54.27 47.06 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.913 0.387 . . . . 0.0 110.72 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 713' ' ' GLU . . . . . 0.419 ' HB2' ' HG ' ' A' ' 709' ' ' LEU . 18.6 mm-40 -60.41 -26.06 66.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.832 179.662 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 714' ' ' HIS . . . . . 0.437 ' CE1' ' CZ ' ' A' ' 706' ' ' TYR . 1.3 m-70 -75.61 -53.86 7.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.114 179.255 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 6.2 mmm180 -64.65 -33.02 74.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.07 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 3.3 mtt180 -67.47 -54.28 21.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.867 0.365 . . . . 0.0 110.805 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . 0.791 HD13 ' HB2' ' A' ' 632' ' ' HIS . 25.9 mt -64.12 -37.47 87.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.478 179.63 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 718' ' ' GLU . . . . . 0.575 ' HG3' HD23 ' A' ' 722' ' ' LEU . 25.5 tt0 -67.63 -53.92 23.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.357 179.605 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.3 -34.76 48.16 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.497 -179.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 720' ' ' GLU . . . . . 0.408 ' O ' ' HG2' ' A' ' 723' ' ' MET . 1.2 mm-40 -67.69 -55.85 11.62 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.06 0.457 . . . . 0.0 110.279 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 721' ' ' VAL . . . . . 0.507 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 44.2 t -60.78 -50.96 78.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.638 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . 0.575 HD23 ' HG3' ' A' ' 718' ' ' GLU . 2.2 mm? -48.79 -46.39 41.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.907 -179.354 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 723' ' ' MET . . . . . 0.578 ' O ' HD12 ' A' ' 727' ' ' ILE . 18.0 ptp -73.99 -40.77 62.72 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.098 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -50.76 -41.53 56.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.759 -179.199 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 725' ' ' LYS . . . . . 0.519 ' NZ ' HD13 ' A' ' 722' ' ' LEU . 0.0 OUTLIER -83.23 -40.2 19.93 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.65 0.262 . . . . 0.0 111.271 -179.687 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -60.56 -52.99 62.84 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.968 0.413 . . . . 0.0 110.836 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 727' ' ' ILE . . . . . 0.616 HG22 ' O ' ' A' ' 727' ' ' ILE . 4.2 mp -89.82 11.62 2.0 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.558 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 6.6 tt -53.87 -42.47 68.64 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.847 0.356 . . . . 0.0 111.152 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -71.98 -70.64 0.32 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.962 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 730' ' ' LYS . . . . . 0.522 ' NZ ' HG23 ' A' ' 727' ' ' ILE . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.96 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 619' ' ' TRP . . . . . 0.572 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.1 OUTLIER . . . . . 0 CA--C 1.528 0.126 0 CA-C-O 120.627 0.251 . . . . 0.0 111.439 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 118.53 161.32 11.78 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.373 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -67.47 -39.81 11.76 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.497 2.131 . . . . 0.0 112.332 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 622' ' ' ASN . . . . . 0.474 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 11.6 p30 -65.08 -35.97 82.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.941 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 623' ' ' VAL . . . . . 0.429 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 42.1 t -67.81 -43.62 86.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.751 179.686 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 624' ' ' GLN . . . . . 0.524 ' HG2' HD11 ' A' ' 722' ' ' LEU . 40.9 tp60 -59.49 -42.68 92.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.526 179.686 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -58.66 -50.75 72.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.429 179.596 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 626' ' ' LEU . . . . . 0.485 ' O ' HD23 ' A' ' 626' ' ' LEU . 6.6 tt -65.7 -28.31 68.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.79 179.611 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 627' ' ' ALA . . . . . 0.411 ' HA ' ' HG2' ' A' ' 630' ' ' LYS . . . -71.4 -52.56 17.89 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.587 -179.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 29.5 p -60.84 -38.63 86.18 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.396 -179.533 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 629' ' ' ILE . . . . . 0.636 HG21 HD23 ' A' ' 653' ' ' LEU . 51.3 mt -66.72 -45.54 87.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.329 -179.728 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 630' ' ' LYS . . . . . 0.411 ' HG2' ' HA ' ' A' ' 627' ' ' ALA . 43.8 pttt -66.24 -33.89 76.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.722 0.296 . . . . 0.0 110.987 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 2.0 tttm -67.35 -46.8 72.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.014 0.435 . . . . 0.0 110.79 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 632' ' ' HIS . . . . . 0.704 ' HB2' HD13 ' A' ' 717' ' ' LEU . 86.6 t60 -67.28 -39.61 86.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.734 179.77 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.626 HD23 HD13 ' A' ' 638' ' ' ILE . 21.8 mt -57.82 -48.99 78.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.047 -179.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 634' ' ' ARG . . . . . 0.421 ' HG3' ' N ' ' A' ' 635' ' ' SER . 0.1 OUTLIER -63.16 -40.6 98.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.831 179.974 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 635' ' ' SER . . . . . 0.421 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 1.6 m -73.68 -19.93 60.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.219 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -90.58 -7.45 52.79 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.677 -179.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 117.92 -13.12 12.98 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.478 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 638' ' ' ILE . . . . . 0.626 HD13 HD23 ' A' ' 633' ' ' LEU . 2.8 mp -94.38 104.59 15.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 120.608 0.242 . . . . 0.0 111.219 -179.716 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -77.56 121.34 23.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.837 0.351 . . . . 0.0 111.007 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 640' ' ' MET . . . . . 0.413 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.9 ttp -133.02 30.19 4.0 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.882 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -65.56 -33.99 77.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.872 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -69.59 -77.39 0.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.846 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 643' ' ' LEU . . . . . 0.445 ' O ' HD12 ' A' ' 643' ' ' LEU . 1.4 pp -179.98 136.68 0.28 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.873 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.81 121.01 7.0 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.499 2.132 . . . . 0.0 112.168 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 645' ' ' LEU . . . . . 0.633 HD12 ' HA ' ' A' ' 650' ' ' GLU . 5.0 tp -119.88 149.52 41.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.221 0.534 . . . . 0.0 111.287 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 646' ' ' ILE . . . . . 0.531 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.2 tt -144.83 130.15 14.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.45 178.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 647' ' ' GLY . . . . . 0.408 ' O ' ' NH1' ' A' ' 691' ' ' ARG . . . 51.91 47.0 54.82 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.269 -0.967 . . . . 0.0 112.086 -179.157 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 64.79 7.67 30.2 Favored Glycine 0 CA--C 1.521 0.421 0 C-N-CA 121.034 -0.603 . . . . 0.0 113.899 179.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 98.7 m -129.73 161.7 30.08 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 117.592 0.696 . . . . 0.0 111.516 -179.21 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 650' ' ' GLU . . . . . 0.633 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.8 OUTLIER -81.19 142.55 33.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.638 179.659 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 651' ' ' LEU . . . . . 0.62 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.9 144.72 47.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.041 0.448 . . . . 0.0 111.309 -179.737 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -94.16 109.18 20.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.782 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 653' ' ' LEU . . . . . 0.636 HD23 HG21 ' A' ' 629' ' ' ILE . 6.3 mp -56.67 -35.41 68.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.867 -180.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 654' ' ' ALA . . . . . 0.474 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -65.09 -46.81 79.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.958 179.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 46.9 t -70.58 -32.66 70.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.562 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 656' ' ' PHE . . . . . 0.484 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.2 OUTLIER -70.55 -46.07 64.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.81 179.881 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -60.14 -49.98 75.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.933 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 658' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 658' ' ' ARG . 0.9 OUTLIER -58.23 -43.99 88.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.963 -179.954 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.49 -48.01 80.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.253 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 660' ' ' ILE . . . . . 0.712 HG21 ' HG2' ' A' ' 666' ' ' MET . 23.3 mt -56.85 -45.73 83.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.916 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -64.68 -47.19 79.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.029 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -62.38 -16.75 56.51 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.441 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . 0.413 ' CE ' ' HB3' ' A' ' 678' ' ' LEU . 0.1 OUTLIER -94.25 31.86 1.63 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.67 0.272 . . . . 0.0 111.295 -179.826 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 76.15 42.37 24.24 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.824 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 78.21 172.76 40.55 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.707 179.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 666' ' ' MET . . . . . 0.712 ' HG2' HG21 ' A' ' 660' ' ' ILE . 0.0 OUTLIER -73.13 -33.66 65.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.769 0.319 . . . . 0.0 111.322 179.963 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 16.0 pt20 -53.05 -43.76 66.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.322 -179.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 668' ' ' GLN . . . . . 0.452 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -64.66 -52.48 57.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.972 0.415 . . . . 0.0 110.707 -179.968 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 669' ' ' VAL . . . . . 0.63 HG21 HG23 ' A' ' 660' ' ' ILE . 90.6 t -49.28 -55.52 4.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.567 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 670' ' ' THR . . . . . 0.56 HG22 ' O ' ' A' ' 666' ' ' MET . 8.8 t -76.19 -51.47 12.05 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -178.467 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 671' ' ' ASP . . . . . 0.492 ' N ' HG23 ' A' ' 670' ' ' THR . 4.8 t70 -63.72 -51.3 65.59 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -177.658 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 672' ' ' LEU . . . . . 0.452 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 9.3 mp -77.3 3.34 13.23 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -179.039 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 49.02 86.35 0.03 OUTLIER 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.966 0.412 . . . . 0.0 110.509 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 21.0 mttt -146.2 21.91 1.37 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.261 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 675' ' ' TRP . . . . . 1.107 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 42.5 m95 -60.91 -28.57 69.02 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 121.401 0.619 . . . . 0.0 110.167 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 676' ' ' ASN . . . . . 0.637 ' CG ' HD11 ' A' ' 692' ' ' LEU . 49.4 m-80 -55.76 -43.84 77.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.534 -179.69 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 2.7 ttmm -77.09 -51.53 10.88 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 120.769 0.318 . . . . 0.0 111.4 -179.49 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.976 HD22 ' HA ' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -54.92 -41.25 70.75 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 179.65 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 679' ' ' ALA . . . . . 0.826 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.78 -34.51 69.48 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.766 179.283 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -53.17 -47.67 68.61 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.394 179.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 20.1 mtm -64.67 -21.57 66.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.764 179.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 682' ' ' LEU . . . . . 0.5 ' O ' ' HB2' ' A' ' 683' ' ' ARG . 3.2 mm? -80.11 -2.08 42.94 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.464 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . 0.815 ' C ' HD12 ' A' ' 684' ' ' ILE . 0.2 OUTLIER 72.34 71.76 0.15 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.925 0.393 . . . . 0.0 111.7 179.81 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . 0.815 HD12 ' C ' ' A' ' 683' ' ' ARG . 2.1 mp -129.22 139.95 37.2 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.062 179.406 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . 0.579 ' HD2' HG23 ' A' ' 684' ' ' ILE . 41.0 Cg_endo -66.83 124.81 12.79 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.303 2.002 . . . . 0.0 112.381 -179.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -19.18 63.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.19 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.34 -18.81 65.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.384 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 688' ' ' ALA . . . . . 0.43 ' CB ' ' NE ' ' A' ' 691' ' ' ARG . . . -84.47 107.08 16.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.863 0.363 . . . . 0.0 111.056 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -70.82 -67.77 0.48 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.06 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 45.1 m-20 -48.96 -20.93 0.57 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.972 -179.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 691' ' ' ARG . . . . . 0.43 ' NE ' ' CB ' ' A' ' 688' ' ' ALA . 1.4 ttm180 -46.37 -40.35 11.83 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.803 0.335 . . . . 0.0 111.297 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . 0.637 HD11 ' CG ' ' A' ' 676' ' ' ASN . 4.5 mm? -63.15 -46.46 87.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.183 -179.758 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.15 -38.67 69.13 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.774 0.321 . . . . 0.0 111.233 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 16.4 mmtt -63.54 -42.19 98.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.989 0.424 . . . . 0.0 110.339 179.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 1.107 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.2 OUTLIER -66.84 -40.67 88.04 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.404 179.646 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.425 ' O ' ' CD2' ' A' ' 699' ' ' TYR . 8.9 mt-30 -57.74 -44.98 86.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.788 179.733 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -77.31 -29.81 53.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.203 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 698' ' ' ALA . . . . . 0.4 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.28 -38.36 84.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.653 -179.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 699' ' ' TYR . . . . . 0.576 ' HB2' HD12 ' A' ' 703' ' ' LEU . 1.8 p90 -83.65 -37.23 23.1 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.864 0.364 . . . . 0.0 110.484 179.875 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 700' ' ' CYS . . . . . 0.562 ' HA ' HD23 ' A' ' 704' ' ' LEU . 6.8 t -62.18 -30.64 71.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.553 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -95.83 -3.49 45.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.32 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 702' ' ' TYR . . . . . 0.4 ' CD1' ' O ' ' A' ' 698' ' ' ALA . 10.1 m-85 -118.46 -78.53 0.58 Allowed 'General case' 0 CA--C 1.529 0.14 0 CA-C-O 120.849 0.356 . . . . 0.0 111.59 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 703' ' ' LEU . . . . . 0.576 HD12 ' HB2' ' A' ' 699' ' ' TYR . 23.2 mt -60.22 -43.85 95.68 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.966 -179.069 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.562 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.4 OUTLIER -47.9 -56.65 7.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.82 0.343 . . . . 0.0 111.647 -179.442 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 42.3 p -54.4 -48.57 71.43 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.405 -179.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 706' ' ' TYR . . . . . 0.596 ' O ' HD22 ' A' ' 709' ' ' LEU . 57.3 t80 -65.51 -29.21 69.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.529 -179.591 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -96.95 0.64 49.24 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -179.438 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 39.8 t -115.54 -12.77 11.6 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 111.771 0.285 . . . . 0.0 111.771 -179.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 709' ' ' LEU . . . . . 0.596 HD22 ' O ' ' A' ' 706' ' ' TYR . 0.3 OUTLIER -79.71 179.46 7.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.743 0.306 . . . . 0.0 111.04 -179.969 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -75.04 164.45 61.28 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.143 -179.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -68.87 -25.94 32.41 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.645 2.23 . . . . 0.0 112.203 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -50.55 -49.83 55.04 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.748 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 713' ' ' GLU . . . . . 0.585 ' HB2' HD11 ' A' ' 709' ' ' LEU . 1.5 mm-40 -59.89 -27.24 66.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.024 179.848 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 714' ' ' HIS . . . . . 0.555 ' CD2' HD21 ' A' ' 709' ' ' LEU . 12.8 m170 -76.14 -54.03 7.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.501 179.484 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.16 -44.25 97.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.437 -179.614 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 20.8 mtp85 -66.19 -54.18 28.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.223 -179.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . 0.704 HD13 ' HB2' ' A' ' 632' ' ' HIS . 53.1 mt -62.64 -39.54 94.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.674 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -67.33 -54.03 24.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.33 179.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -50.53 -34.7 26.39 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.337 -179.791 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 720' ' ' GLU . . . . . 0.429 ' O ' ' HG2' ' A' ' 723' ' ' MET . 0.5 OUTLIER -69.39 -55.43 10.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.005 0.431 . . . . 0.0 110.561 179.626 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 721' ' ' VAL . . . . . 0.634 HG23 ' O ' ' A' ' 717' ' ' LEU . 16.8 t -62.03 -54.94 27.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.156 -179.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . 0.524 HD11 ' HG2' ' A' ' 624' ' ' GLN . 1.2 mp -50.51 -44.18 56.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.009 -179.266 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 723' ' ' MET . . . . . 0.622 ' O ' HD12 ' A' ' 727' ' ' ILE . 16.9 ptp -71.44 -40.31 70.47 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.496 -0.481 . . . . 0.0 110.024 179.719 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 724' ' ' GLU . . . . . 0.4 ' N ' ' HG3' ' A' ' 723' ' ' MET . 5.6 mm-40 -57.49 -31.58 66.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.381 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 725' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.14 -43.14 13.28 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.404 -179.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -66.52 -48.93 68.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.834 0.349 . . . . 0.0 111.193 -179.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 727' ' ' ILE . . . . . 0.631 HG22 ' O ' ' A' ' 727' ' ' ILE . 3.9 mp -88.96 11.67 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.534 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 5.6 tt -57.38 -36.41 71.21 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.789 0.328 . . . . 0.0 111.028 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -64.57 -68.65 0.34 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.934 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.895 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 619' ' ' TRP . . . . . 0.541 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.117 0 CA-C-O 120.684 0.278 . . . . 0.0 111.258 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 123.44 163.25 11.71 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.443 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -66.75 -39.11 15.93 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.542 2.162 . . . . 0.0 112.118 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 622' ' ' ASN . . . . . 0.668 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 6.0 p30 -63.15 -39.25 94.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.888 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 623' ' ' VAL . . . . . 0.465 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 38.8 t -73.29 -35.32 46.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.781 179.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 624' ' ' GLN . . . . . 0.656 ' CG ' HD11 ' A' ' 722' ' ' LEU . 2.2 tm0? -60.2 -42.43 95.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.689 179.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 4.8 tpp180 -69.32 -48.54 61.17 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.72 179.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 8.1 tt -61.45 -30.74 70.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.828 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 627' ' ' ALA . . . . . 0.479 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -72.02 -50.63 26.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.201 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -57.2 -46.94 82.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.999 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 629' ' ' ILE . . . . . 0.655 HG21 HD23 ' A' ' 653' ' ' LEU . 12.6 mt -64.47 -39.2 84.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.91 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 630' ' ' LYS . . . . . 0.487 ' HA ' HD12 ' A' ' 633' ' ' LEU . 10.6 ttpt -60.77 -49.73 76.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.738 179.89 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 9.5 tttm -59.5 -38.17 80.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.75 179.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 632' ' ' HIS . . . . . 0.449 ' CE1' ' CD1' ' A' ' 709' ' ' LEU . 81.8 t60 -70.08 -44.25 69.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.83 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 633' ' ' LEU . . . . . 0.662 HD13 ' SD ' ' A' ' 640' ' ' MET . 10.6 mt -55.89 -50.2 71.3 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.369 -179.552 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.92 -41.8 97.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.765 0.317 . . . . 0.0 110.75 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 6.7 t -73.5 -11.5 60.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.958 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 35.5 mm-40 -99.04 -10.59 22.41 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.551 -179.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 117.12 -0.83 19.31 Favored Glycine 0 C--N 1.332 0.34 0 C-N-CA 120.581 -0.819 . . . . 0.0 112.623 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 638' ' ' ILE . . . . . 0.415 HG21 ' CE2' ' A' ' 702' ' ' TYR . 13.8 mt -108.44 109.94 30.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 120.712 0.292 . . . . 0.0 111.327 -179.47 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 5.1 m -83.81 115.06 22.05 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.861 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 640' ' ' MET . . . . . 0.662 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.6 mtp -125.38 30.73 5.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.964 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -64.02 -30.76 71.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.956 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -74.51 -80.09 0.08 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.957 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 643' ' ' LEU . . . . . 0.417 HD12 ' HA ' ' A' ' 643' ' ' LEU . 8.7 tp -179.08 132.09 0.27 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.845 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 644' ' ' PRO . . . . . 0.54 ' HB2' HD11 ' A' ' 651' ' ' LEU . 66.2 Cg_endo -74.49 137.86 23.55 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.481 2.121 . . . . 0.0 112.279 179.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 645' ' ' LEU . . . . . 0.636 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.8 tp -129.19 151.6 49.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.187 0.518 . . . . 0.0 111.236 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 646' ' ' ILE . . . . . 0.665 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.3 tt -149.64 133.51 8.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.873 179.086 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 54.64 38.35 63.46 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.342 -0.933 . . . . 0.0 112.221 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.05 7.92 63.59 Favored Glycine 0 C--N 1.333 0.377 0 C-N-CA 120.924 -0.655 . . . . 0.0 113.595 179.353 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 2.1 m -133.73 163.89 28.45 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 117.315 0.557 . . . . 0.0 111.424 -179.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 650' ' ' GLU . . . . . 0.636 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.3 OUTLIER -78.28 145.52 35.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.669 179.679 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 651' ' ' LEU . . . . . 0.609 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.79 145.0 47.97 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.085 0.469 . . . . 0.0 111.466 -179.615 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -96.85 109.25 21.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.725 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 653' ' ' LEU . . . . . 0.655 HD23 HG21 ' A' ' 629' ' ' ILE . 8.2 mp -53.85 -35.29 61.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.949 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 654' ' ' ALA . . . . . 0.668 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -65.02 -43.57 92.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.007 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 49.6 t -72.87 -33.6 66.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.655 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 656' ' ' PHE . . . . . 0.44 ' CE2' ' HG ' ' A' ' 682' ' ' LEU . 0.3 OUTLIER -71.47 -47.92 52.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.805 179.891 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -59.45 -49.16 78.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.893 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 22.2 tpp180 -59.66 -41.93 91.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.868 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 659' ' ' LEU . . . . . 0.752 HD22 ' CD2' ' A' ' 682' ' ' LEU . 0.1 OUTLIER -58.5 -49.18 78.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.103 -179.825 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 660' ' ' ILE . . . . . 0.685 HG23 HG21 ' A' ' 669' ' ' VAL . 27.9 mt -56.79 -45.66 83.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.791 0.329 . . . . 0.0 110.819 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -62.73 -42.31 99.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.884 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -72.11 -11.02 60.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.307 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 663' ' ' MET . . . . . 0.525 ' HE1' ' HB3' ' A' ' 678' ' ' LEU . 0.6 OUTLIER -96.49 32.3 2.05 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.806 0.336 . . . . 0.0 111.047 -179.876 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 75.06 36.55 45.93 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.602 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 665' ' ' GLY . . . . . 0.426 ' O ' HG23 ' A' ' 669' ' ' VAL . . . 82.49 171.23 46.46 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.53 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 666' ' ' MET . . . . . 0.707 ' O ' HG22 ' A' ' 670' ' ' THR . 0.0 OUTLIER -72.49 -32.82 66.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.839 0.352 . . . . 0.0 111.035 179.962 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 27.5 tt0 -54.13 -48.88 70.32 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.193 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 668' ' ' GLN . . . . . 0.447 ' HG3' HD13 ' A' ' 672' ' ' LEU . 0.0 OUTLIER -63.5 -50.63 68.88 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.827 0.346 . . . . 0.0 111.321 -179.632 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 669' ' ' VAL . . . . . 0.685 HG21 HG23 ' A' ' 660' ' ' ILE . 57.2 t -49.04 -52.66 9.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.917 0.389 . . . . 0.0 111.159 179.881 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 670' ' ' THR . . . . . 0.707 HG22 ' O ' ' A' ' 666' ' ' MET . 7.6 t -76.3 -53.92 7.51 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -178.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 671' ' ' ASP . . . . . 0.468 ' N ' HG23 ' A' ' 670' ' ' THR . 23.6 m-20 -60.2 -51.41 69.68 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 -177.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 672' ' ' LEU . . . . . 0.447 HD13 ' HG3' ' A' ' 668' ' ' GLN . 6.9 mp -75.96 1.66 14.69 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -178.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 49.54 82.17 0.05 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.999 0.428 . . . . 0.0 110.297 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 11.1 ttpt -142.19 23.4 2.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.272 -179.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 675' ' ' TRP . . . . . 1.1 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 38.5 m95 -62.49 -28.54 69.9 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 121.361 0.6 . . . . 0.0 110.21 179.809 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -56.69 -44.41 81.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.49 -179.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.11 -51.51 12.07 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 120.814 0.34 . . . . 0.0 111.267 -179.602 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 678' ' ' LEU . . . . . 0.98 HD22 ' HA ' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.21 -40.44 70.79 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 179.523 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 679' ' ' ALA . . . . . 0.839 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.64 -33.9 69.32 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.59 179.188 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -53.54 -48.73 68.81 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.484 179.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 2.4 mtm -64.12 -20.02 65.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.968 179.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 682' ' ' LEU . . . . . 0.752 ' CD2' HD22 ' A' ' 659' ' ' LEU . 3.7 mm? -81.85 -0.98 45.98 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.513 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 683' ' ' ARG . . . . . 0.647 ' C ' HD12 ' A' ' 684' ' ' ILE . 5.1 mmm180 66.84 71.88 0.37 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.895 0.379 . . . . 0.0 111.603 179.729 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 684' ' ' ILE . . . . . 0.647 HD12 ' C ' ' A' ' 683' ' ' ARG . 2.1 mp -123.24 139.06 30.97 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.368 179.52 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 685' ' ' PRO . . . . . 0.507 ' HD2' HG23 ' A' ' 684' ' ' ILE . 33.0 Cg_endo -64.79 123.61 11.92 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.422 2.082 . . . . 0.0 112.454 -179.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 4.1 mmmt -69.92 -20.47 63.35 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.212 179.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 19.1 p -65.52 -23.86 66.98 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.555 -179.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 688' ' ' ALA . . . . . 0.458 ' HB3' ' HB3' ' A' ' 691' ' ' ARG . . . -69.14 110.77 4.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.756 0.312 . . . . 0.0 111.323 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -83.38 4.68 26.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.527 179.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -119.33 -17.79 8.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.904 0.383 . . . . 0.0 110.674 179.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 691' ' ' ARG . . . . . 0.641 ' CG ' HD22 ' A' ' 692' ' ' LEU . 8.3 ptt85 -49.81 -36.47 26.61 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.542 -179.715 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 692' ' ' LEU . . . . . 0.641 HD22 ' CG ' ' A' ' 691' ' ' ARG . 2.6 mm? -68.77 -52.64 28.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.623 -179.25 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.99 -39.65 69.1 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.838 0.352 . . . . 0.0 111.288 -179.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -61.86 -40.0 93.83 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.094 0.473 . . . . 0.0 110.15 179.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 695' ' ' LEU . . . . . 1.1 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 2.7 tp -65.57 -45.34 83.67 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.53 179.57 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 696' ' ' GLN . . . . . 0.464 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 9.8 mt-30 -55.43 -50.85 68.74 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.05 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -74.14 -29.67 61.92 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.01 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 698' ' ' ALA . . . . . 0.416 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.89 -39.29 83.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.602 -179.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 699' ' ' TYR . . . . . 0.517 ' CD2' ' CZ2' ' A' ' 675' ' ' TRP . 0.7 OUTLIER -86.0 -31.25 22.14 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.032 0.444 . . . . 0.0 110.485 179.84 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 700' ' ' CYS . . . . . 0.442 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 43.8 t -66.92 -30.52 70.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.852 179.89 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.14 -1.16 37.39 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.567 -179.719 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 702' ' ' TYR . . . . . 0.455 ' CD2' ' CD2' ' A' ' 633' ' ' LEU . 5.8 m-85 -119.06 -79.08 0.59 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.821 0.343 . . . . 0.0 111.326 -179.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 703' ' ' LEU . . . . . 0.627 ' CD2' HD12 ' A' ' 660' ' ' ILE . 3.8 tp -56.44 -43.06 79.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.571 -179.395 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 704' ' ' LEU . . . . . 0.442 ' HB2' ' O ' ' A' ' 700' ' ' CYS . 1.1 mm? -53.01 -37.17 61.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.893 0.378 . . . . 0.0 111.164 -179.771 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 3.9 m -65.63 -54.94 20.68 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.796 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 706' ' ' TYR . . . . . 0.625 ' O ' HD22 ' A' ' 709' ' ' LEU . 21.0 t80 -60.35 -29.19 68.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.738 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 4.8 p30 -96.91 -7.21 33.88 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -179.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 708' ' ' SER . . . . . 0.402 ' CB ' ' O ' ' A' ' 704' ' ' LEU . 41.8 m -102.89 -22.55 13.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.708 0.29 . . . . 0.0 111.363 -179.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 709' ' ' LEU . . . . . 0.658 ' O ' HD23 ' A' ' 709' ' ' LEU . 0.2 OUTLIER -71.43 170.97 12.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.772 0.32 . . . . 0.0 111.005 -179.941 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.63 166.75 41.38 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.168 -179.687 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 711' ' ' PRO . . . . . 0.421 ' O ' ' HB2' ' A' ' 714' ' ' HIS . 38.0 Cg_endo -66.53 -32.03 40.25 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.57 2.18 . . . . 0.0 112.045 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -48.86 -48.69 41.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.578 179.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 713' ' ' GLU . . . . . 0.437 ' HB2' ' CD1' ' A' ' 709' ' ' LEU . 6.2 mm-40 -59.71 -26.2 65.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.111 179.633 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 714' ' ' HIS . . . . . 0.637 ' HD2' HD21 ' A' ' 709' ' ' LEU . 1.6 m-70 -75.87 -54.05 7.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.387 179.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.77 -42.43 99.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.282 -179.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -66.37 -54.25 26.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.821 0.343 . . . . 0.0 111.16 -179.598 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 717' ' ' LEU . . . . . 0.539 ' O ' HG23 ' A' ' 721' ' ' VAL . 73.4 mt -63.64 -39.91 95.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.723 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 718' ' ' GLU . . . . . 0.605 ' HG3' HD13 ' A' ' 722' ' ' LEU . 23.4 tt0 -67.52 -54.32 21.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.302 179.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -50.72 -34.94 28.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.358 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 720' ' ' GLU . . . . . 0.434 ' O ' ' HG2' ' A' ' 723' ' ' MET . 2.9 mm-40 -70.51 -55.42 8.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.996 0.427 . . . . 0.0 110.723 179.842 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 721' ' ' VAL . . . . . 0.541 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 38.6 t -62.48 -54.87 28.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.112 -179.662 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 722' ' ' LEU . . . . . 0.656 HD11 ' CG ' ' A' ' 624' ' ' GLN . 3.6 mp -53.57 -40.04 65.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.872 -179.378 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 723' ' ' MET . . . . . 0.672 ' O ' HD12 ' A' ' 727' ' ' ILE . 9.5 ptp -74.59 -41.21 60.88 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 120.407 -0.517 . . . . 0.0 109.949 179.475 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 724' ' ' GLU . . . . . 0.409 ' N ' ' HG3' ' A' ' 723' ' ' MET . 4.2 mm-40 -55.61 -42.74 75.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.835 -179.414 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 725' ' ' LYS . . . . . 0.43 ' HB3' ' CZ3' ' A' ' 619' ' ' TRP . 0.0 OUTLIER -79.12 -36.66 40.27 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.661 -179.29 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -69.39 -53.27 20.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.837 0.351 . . . . 0.0 111.044 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 727' ' ' ILE . . . . . 0.672 HD12 ' O ' ' A' ' 723' ' ' MET . 3.7 mp -88.51 11.65 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.621 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 1.9 tt -53.98 -47.4 71.42 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.798 0.332 . . . . 0.0 111.121 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -73.21 -53.45 10.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.949 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 24.3 mtmt . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.896 179.968 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.236 0 N-CA-C 112.494 -0.242 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.0 -28.39 24.16 Favored 'Trans proline' 0 C--N 1.343 0.288 0 C-N-CA 122.641 2.228 . . . . 0.0 112.287 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 11.3 mt -80.75 179.02 8.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.924 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 94.78 62.0 1.03 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.502 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -98.85 31.84 2.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.783 0.325 . . . . 0.0 110.928 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 23.3 mt -67.27 170.72 6.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.872 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 139.18 -52.85 0.71 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.517 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.89 -143.85 0.39 Allowed 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 110.445 -0.206 . . . . 0.0 110.445 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 6.5 mtt-85 -71.63 137.36 47.86 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.95 0.405 . . . . 0.0 111.169 -179.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 619' ' ' TRP . . . . . 0.491 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.0 OUTLIER -82.66 -14.66 54.28 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.366 179.902 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 122.11 163.76 12.0 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.507 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_endo -67.61 -40.76 9.59 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.597 2.198 . . . . 0.0 112.26 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 41.1 m-80 -62.27 -36.42 82.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.854 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 623' ' ' VAL . . . . . 0.481 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 43.0 t -75.77 -39.63 38.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.817 179.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 624' ' ' GLN . . . . . 0.523 ' CG ' HD11 ' A' ' 722' ' ' LEU . 3.8 tm0? -64.76 -40.53 95.44 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.669 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.24 -49.97 65.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.736 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 626' ' ' LEU . . . . . 0.619 ' O ' HD23 ' A' ' 626' ' ' LEU . 7.1 tt -63.48 -32.13 73.49 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.914 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -71.49 -50.16 34.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.317 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.21 -46.46 82.89 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.157 -179.727 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 30.3 mt -64.24 -40.85 90.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.056 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 7.4 ttpt -62.82 -47.24 84.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.999 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 1.3 tttm -59.1 -40.47 85.44 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.258 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 632' ' ' HIS . . . . . 0.892 ' CE1' HD21 ' A' ' 709' ' ' LEU . 82.6 t60 -72.78 -42.1 64.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.085 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.67 HD13 ' SD ' ' A' ' 640' ' ' MET . 20.2 mt -55.96 -49.85 72.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.355 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 634' ' ' ARG . . . . . 0.41 ' HA ' ' O ' ' A' ' 638' ' ' ILE . 1.0 OUTLIER -68.34 -39.48 81.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.847 179.988 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 1.3 m -73.68 -11.58 60.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.353 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -100.32 -4.62 28.83 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 111.733 0.271 . . . . 0.0 111.733 -179.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 113.23 -0.44 25.27 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.493 -0.86 . . . . 0.0 112.593 179.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 638' ' ' ILE . . . . . 0.41 ' O ' ' HA ' ' A' ' 634' ' ' ARG . 13.7 mt -108.63 104.68 17.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.372 0 CA-C-O 120.666 0.27 . . . . 0.0 111.202 -179.421 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 1.6 m -77.42 116.8 18.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.876 0.369 . . . . 0.0 110.94 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 640' ' ' MET . . . . . 0.67 ' SD ' HD13 ' A' ' 633' ' ' LEU . 2.1 ttp -130.49 30.7 4.67 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.838 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -66.81 -39.31 87.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.01 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 642' ' ' GLU . . . . . 0.532 ' O ' HD12 ' A' ' 643' ' ' LEU . 6.6 mm-40 -63.57 -79.9 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.935 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 643' ' ' LEU . . . . . 0.532 HD12 ' O ' ' A' ' 642' ' ' GLU . 0.1 OUTLIER -178.37 132.34 0.3 Allowed Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.803 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 644' ' ' PRO . . . . . 0.548 ' HB2' HD11 ' A' ' 651' ' ' LEU . 74.4 Cg_endo -75.23 142.76 27.57 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.488 2.125 . . . . 0.0 112.266 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 645' ' ' LEU . . . . . 0.658 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.8 tp -133.84 151.93 51.7 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.211 0.529 . . . . 0.0 111.211 179.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 646' ' ' ILE . . . . . 0.742 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.1 tt -149.8 133.89 8.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.905 179.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.41 38.55 57.8 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.363 -0.922 . . . . 0.0 112.097 -179.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.2 7.88 64.17 Favored Glycine 0 CA--C 1.52 0.385 0 C-N-CA 120.94 -0.648 . . . . 0.0 113.584 179.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -132.67 162.55 31.1 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 117.311 0.556 . . . . 0.0 111.4 -179.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 650' ' ' GLU . . . . . 0.658 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.7 OUTLIER -77.78 145.21 36.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.793 179.888 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 651' ' ' LEU . . . . . 0.638 HD23 ' HD2' ' A' ' 656' ' ' PHE . 0.0 OUTLIER -135.22 145.37 47.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.373 -179.695 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -99.89 113.33 25.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.944 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -52.37 -39.44 60.79 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.127 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -63.69 -43.88 95.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.03 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 10.6 t -70.07 -38.31 75.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.746 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 656' ' ' PHE . . . . . 0.638 ' HD2' HD23 ' A' ' 651' ' ' LEU . 0.1 OUTLIER -68.7 -46.3 69.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.794 179.943 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 43.9 t80 -57.46 -48.79 78.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.893 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -60.66 -40.73 93.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.955 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . 0.453 HD11 ' CE ' ' A' ' 681' ' ' MET . 0.2 OUTLIER -57.95 -51.67 68.69 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.163 -179.752 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 660' ' ' ILE . . . . . 0.624 HG23 HG21 ' A' ' 669' ' ' VAL . 33.3 mt -56.75 -46.14 83.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 120.821 0.343 . . . . 0.0 111.127 -179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 23.6 t30 -61.43 -39.82 92.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.078 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -68.26 -13.85 62.56 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.51 -179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.46 36.61 1.24 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.797 0.332 . . . . 0.0 111.099 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 67.92 25.88 74.12 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.644 -0.788 . . . . 0.0 112.424 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 96.4 170.07 34.57 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.541 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 666' ' ' MET . . . . . 0.521 ' O ' HG22 ' A' ' 670' ' ' THR . 10.0 tpt -65.6 -37.74 87.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.727 0.298 . . . . 0.0 111.217 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 667' ' ' GLN . . . . . 0.432 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 4.9 pt20 -50.62 -43.69 56.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.449 -179.665 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 668' ' ' GLN . . . . . 0.419 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -66.96 -52.59 40.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.815 0.341 . . . . 0.0 110.973 -179.9 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 669' ' ' VAL . . . . . 0.624 HG21 HG23 ' A' ' 660' ' ' ILE . 55.4 t -49.19 -54.65 5.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.461 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 670' ' ' THR . . . . . 0.521 HG22 ' O ' ' A' ' 666' ' ' MET . 14.0 t -76.15 -52.51 9.94 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -178.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 671' ' ' ASP . . . . . 0.499 ' N ' HG23 ' A' ' 670' ' ' THR . 19.0 t70 -59.45 -51.15 71.12 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -177.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 672' ' ' LEU . . . . . 0.419 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 4.5 mm? -76.42 0.87 18.08 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 3.1 mtpm? 49.71 81.77 0.06 Allowed 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.017 0.437 . . . . 0.0 110.363 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 3.9 mttm -144.48 20.18 1.7 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.193 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 675' ' ' TRP . . . . . 1.147 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 26.0 m95 -55.75 -29.85 60.25 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.324 0.583 . . . . 0.0 110.236 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 -55.88 -41.7 74.83 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.843 -179.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.69 -51.76 10.07 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.173 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 1.057 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -58.09 -40.51 81.32 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 179.691 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 679' ' ' ALA . . . . . 0.801 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -70.27 -36.13 74.22 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.554 179.184 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -53.36 -48.42 68.57 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.403 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 681' ' ' MET . . . . . 0.453 ' CE ' HD11 ' A' ' 659' ' ' LEU . 31.6 mtm -64.08 -23.07 67.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.844 179.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 682' ' ' LEU . . . . . 0.471 HD23 ' O ' ' A' ' 678' ' ' LEU . 3.4 mm? -78.21 -3.12 41.07 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.472 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . 0.695 ' C ' HD12 ' A' ' 684' ' ' ILE . 3.4 mtp85 70.4 71.74 0.21 Allowed 'General case' 0 N--CA 1.463 0.187 0 CA-C-O 120.915 0.388 . . . . 0.0 111.592 179.6 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . 0.695 HD12 ' C ' ' A' ' 683' ' ' ARG . 2.2 mp -123.66 141.37 36.39 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.223 179.459 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . 0.651 ' HD2' HG23 ' A' ' 684' ' ' ILE . 44.2 Cg_endo -69.07 120.94 7.77 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.543 2.162 . . . . 0.0 112.752 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.01 -21.59 63.19 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.103 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.46 -22.33 66.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.601 -179.414 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 688' ' ' ALA . . . . . 0.74 ' HB3' ' HG2' ' A' ' 691' ' ' ARG . . . -72.24 116.24 12.43 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.929 0.395 . . . . 0.0 111.218 -179.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -83.44 4.9 25.7 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.396 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -121.88 -15.18 7.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.087 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 691' ' ' ARG . . . . . 0.809 ' HG3' HD22 ' A' ' 692' ' ' LEU . 0.5 OUTLIER -55.84 -32.8 63.92 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.088 -179.639 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . 0.809 HD22 ' HG3' ' A' ' 691' ' ' ARG . 3.3 mm? -70.58 -54.12 13.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.462 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.23 -37.66 72.0 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.417 -179.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 2.8 mmmt -64.28 -38.63 91.73 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.089 0.471 . . . . 0.0 109.896 179.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 1.147 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 4.3 tp -64.9 -47.12 78.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.812 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.404 ' HA ' ' CD2' ' A' ' 699' ' ' TYR . 24.8 mt-30 -55.21 -49.01 73.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.206 -179.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -76.02 -29.65 58.19 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.206 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . 0.406 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.26 -36.83 82.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.879 -179.585 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 699' ' ' TYR . . . . . 0.504 ' CE1' ' HE2' ' A' ' 666' ' ' MET . 1.5 p90 -85.63 -36.31 20.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.973 0.416 . . . . 0.0 110.495 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 700' ' ' CYS . . . . . . . . . . . . . 5.6 t -62.95 -30.59 71.69 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.538 179.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -96.77 -5.32 38.8 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.453 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 702' ' ' TYR . . . . . 0.411 ' CD2' HD21 ' A' ' 633' ' ' LEU . 6.1 m-85 -119.11 -78.21 0.58 Allowed 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 120.851 0.358 . . . . 0.0 111.254 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 703' ' ' LEU . . . . . 0.474 HD13 ' HA ' ' A' ' 703' ' ' LEU . 3.9 mm? -55.34 -42.62 74.07 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.47 -179.506 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.456 HD23 ' CE1' ' A' ' 699' ' ' TYR . 1.1 mm? -61.64 -56.03 24.16 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.144 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.65 -55.27 31.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.961 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 706' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -59.59 -51.11 71.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.017 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 38.0 t0 -58.8 -20.57 51.32 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.282 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 1.4 m -84.29 -16.3 43.58 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.974 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 709' ' ' LEU . . . . . 0.892 HD21 ' CE1' ' A' ' 632' ' ' HIS . 62.3 mt -50.63 141.37 12.77 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.501 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 710' ' ' SER . . . . . 0.454 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.6 OUTLIER -75.92 168.25 29.5 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.597 179.742 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . 0.454 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 10.7 Cg_endo -54.13 -25.88 39.42 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.53 2.154 . . . . 0.0 112.376 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -69.98 -53.97 15.37 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.019 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 713' ' ' GLU . . . . . 0.519 ' HB2' ' HB3' ' A' ' 709' ' ' LEU . 62.1 mm-40 -59.73 -26.22 65.46 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.907 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 8.1 m-70 -75.89 -54.16 7.33 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.355 179.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -63.28 -41.77 99.04 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.344 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 2.8 mmm-85 -65.49 -54.2 31.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.858 0.361 . . . . 0.0 111.29 -179.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . 0.482 HD13 ' HB2' ' A' ' 632' ' ' HIS . 55.0 mt -65.44 -40.63 93.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.015 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . 0.74 ' HG2' HD22 ' A' ' 722' ' ' LEU . 30.8 tt0 -67.99 -54.32 19.38 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.639 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.98 -34.55 56.52 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.465 -179.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 720' ' ' GLU . . . . . 0.43 ' O ' ' HG2' ' A' ' 723' ' ' MET . 0.4 OUTLIER -67.51 -55.9 11.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.021 0.438 . . . . 0.0 110.494 179.832 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 721' ' ' VAL . . . . . 0.491 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 33.3 t -64.06 -52.92 50.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.156 -179.637 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . 0.74 HD22 ' HG2' ' A' ' 718' ' ' GLU . 5.1 mp -49.03 -44.8 41.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.918 -179.397 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 723' ' ' MET . . . . . 0.527 ' HB2' HD13 ' A' ' 727' ' ' ILE . 18.8 ptp -72.19 -40.04 68.19 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.239 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 724' ' ' GLU . . . . . 0.409 ' N ' ' HG3' ' A' ' 723' ' ' MET . 5.5 mm-40 -52.64 -34.84 53.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.436 -179.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 725' ' ' LYS . . . . . 0.455 ' HD3' ' CE2' ' A' ' 619' ' ' TRP . 4.4 pttm -86.09 -40.29 15.88 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.455 -179.645 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -66.14 -52.59 46.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.383 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 727' ' ' ILE . . . . . 0.662 HG22 ' O ' ' A' ' 727' ' ' ILE . 4.6 mp -87.09 11.55 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.679 -179.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 728' ' ' LEU . . . . . 0.43 ' O ' HD23 ' A' ' 728' ' ' LEU . 4.9 tt -57.86 -32.57 67.78 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.881 0.372 . . . . 0.0 110.925 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -65.63 -68.8 0.34 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.927 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.874 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.21 0 N-CA-C 112.581 -0.208 . . . . 0.0 112.581 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -53.13 -42.46 64.61 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.529 2.153 . . . . 0.0 112.287 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -88.27 162.64 16.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.887 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . -135.02 68.08 0.54 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.438 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 67.8 m 61.75 69.17 0.65 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.876 0.369 . . . . 0.0 110.803 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 28.9 mt -91.53 169.04 11.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.002 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 123.14 -74.49 0.38 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.456 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 3.2 mtp180 59.33 134.59 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 121.241 0.543 . . . . 0.0 111.441 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.43 140.11 30.25 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.82 179.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 619' ' ' TRP . . . . . 0.444 ' CE2' ' HD2' ' A' ' 725' ' ' LYS . 0.1 OUTLIER -72.41 -8.83 57.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.369 179.959 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 119.78 159.04 10.79 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.47 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -66.99 -40.9 10.9 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.578 2.186 . . . . 0.0 112.013 179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 622' ' ' ASN . . . . . 0.656 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 19.6 m-80 -64.61 -34.91 79.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.72 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 623' ' ' VAL . . . . . 0.417 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 38.6 t -72.98 -39.98 58.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.89 179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 624' ' ' GLN . . . . . 0.567 ' CG ' HD11 ' A' ' 722' ' ' LEU . 3.1 tm0? -60.63 -41.18 94.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.709 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 6.6 mpt_? -67.0 -50.83 60.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.824 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 8.3 tt -62.01 -29.97 70.63 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.041 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . 0.411 ' HA ' ' HG2' ' A' ' 630' ' ' LYS . . . -70.98 -45.07 64.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.434 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -65.13 -38.85 91.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.262 -179.668 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 38.8 mt -66.8 -46.32 85.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.497 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 630' ' ' LYS . . . . . 0.456 ' HG3' ' N ' ' A' ' 631' ' ' LYS . 19.2 pttt -66.09 -32.6 74.15 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.798 0.332 . . . . 0.0 110.996 -179.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 631' ' ' LYS . . . . . 0.456 ' N ' ' HG3' ' A' ' 630' ' ' LYS . 0.0 OUTLIER -66.39 -44.76 82.19 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.991 0.424 . . . . 0.0 110.735 179.838 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 632' ' ' HIS . . . . . 0.847 ' CE1' HD21 ' A' ' 709' ' ' LEU . 86.2 t60 -71.3 -38.8 71.76 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.673 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.415 HD13 ' SD ' ' A' ' 640' ' ' MET . 47.6 mt -58.33 -49.8 75.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.016 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 634' ' ' ARG . . . . . 0.455 ' HG3' ' N ' ' A' ' 635' ' ' SER . 3.6 ptp180 -64.74 -40.32 95.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.866 0.365 . . . . 0.0 110.474 179.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 635' ' ' SER . . . . . 0.455 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 0.5 OUTLIER -73.86 -11.63 60.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.946 179.262 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 636' ' ' GLN . . . . . 0.409 ' HG3' ' NE2' ' A' ' 632' ' ' HIS . 33.4 mm-40 -98.6 -7.12 28.66 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.564 -179.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 114.05 -1.05 24.17 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.584 -0.817 . . . . 0.0 112.497 179.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 638' ' ' ILE . . . . . 0.409 HG21 ' CZ ' ' A' ' 702' ' ' TYR . 12.7 mt -108.11 104.77 17.61 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 CA-C-O 120.635 0.255 . . . . 0.0 111.341 -179.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.6 121.19 21.22 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.825 0.345 . . . . 0.0 111.02 179.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 640' ' ' MET . . . . . 0.415 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.9 ttp -133.56 28.74 3.96 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.87 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -69.22 -30.71 68.94 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.913 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -71.61 -78.21 0.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.817 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 2.5 pp -179.93 128.37 0.24 Allowed Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.827 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 644' ' ' PRO . . . . . 0.543 ' HB2' HD11 ' A' ' 651' ' ' LEU . 64.6 Cg_endo -73.75 132.72 17.57 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.397 2.065 . . . . 0.0 112.289 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 645' ' ' LEU . . . . . 0.611 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.9 tp -123.67 151.73 42.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.192 0.52 . . . . 0.0 111.276 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 646' ' ' ILE . . . . . 0.81 HD11 ' HA ' ' A' ' 695' ' ' LEU . 0.7 OUTLIER -149.68 133.41 8.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.979 179.108 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 54.93 37.7 63.18 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.365 -0.922 . . . . 0.0 112.228 -179.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.89 7.66 66.64 Favored Glycine 0 C--N 1.332 0.335 0 C-N-CA 120.942 -0.647 . . . . 0.0 113.563 179.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.9 m -134.36 164.38 27.56 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 117.35 0.575 . . . . 0.0 111.417 -179.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 650' ' ' GLU . . . . . 0.611 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.3 OUTLIER -77.69 145.67 36.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.757 179.789 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 651' ' ' LEU . . . . . 0.615 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.93 145.15 47.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.384 -179.71 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -98.3 111.93 24.1 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.888 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -52.16 -35.74 49.53 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.056 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 654' ' ' ALA . . . . . 0.656 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -68.61 -44.93 73.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.115 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 10.7 t -67.99 -36.73 80.52 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.656 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 656' ' ' PHE . . . . . 0.581 ' HD2' HD23 ' A' ' 651' ' ' LEU . 0.1 OUTLIER -68.46 -44.47 74.79 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.826 179.908 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 56.6 t80 -58.69 -48.73 80.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.904 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 1.4 ttm180 -59.31 -43.03 92.69 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.99 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . 0.67 HD11 ' CE ' ' A' ' 681' ' ' MET . 0.2 OUTLIER -56.22 -49.71 73.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.145 -179.835 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 660' ' ' ILE . . . . . 0.604 HG23 HG21 ' A' ' 669' ' ' VAL . 16.9 mt -57.43 -44.71 85.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.821 0.343 . . . . 0.0 110.786 179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -65.31 -47.52 76.28 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.271 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -55.5 -20.44 12.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.747 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.82 19.6 3.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.517 0.199 . . . . 0.0 111.508 -179.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 90.84 -18.19 51.73 Favored Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.562 -0.827 . . . . 0.0 112.725 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 665' ' ' GLY . . . . . 0.422 ' O ' HG23 ' A' ' 669' ' ' VAL . . . 147.37 175.34 20.12 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.369 -179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 666' ' ' MET . . . . . 0.507 ' O ' HG22 ' A' ' 670' ' ' THR . 0.0 OUTLIER -72.04 -36.69 69.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.898 0.38 . . . . 0.0 111.067 -179.928 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 667' ' ' GLN . . . . . 0.405 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 3.9 pt20 -56.08 -42.78 77.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.255 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 668' ' ' GLN . . . . . 0.549 ' HG3' HD11 ' A' ' 672' ' ' LEU . 0.0 OUTLIER -65.07 -45.14 86.54 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.956 0.408 . . . . 0.0 110.82 -179.988 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 669' ' ' VAL . . . . . 0.604 HG21 HG23 ' A' ' 660' ' ' ILE . 57.7 t -57.64 -55.71 19.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.564 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 670' ' ' THR . . . . . 0.507 HG22 ' O ' ' A' ' 666' ' ' MET . 9.7 t -76.04 -54.18 7.24 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.219 0.822 . . . . 0.0 113.219 -178.539 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 671' ' ' ASP . . . . . 0.507 ' N ' HG23 ' A' ' 670' ' ' THR . 7.1 t0 -56.21 -51.11 69.26 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -178.328 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 672' ' ' LEU . . . . . 0.549 HD11 ' HG3' ' A' ' 668' ' ' GLN . 28.0 mt -75.0 -1.81 24.36 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -179.117 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 11.3 mttp 50.46 84.15 0.04 OUTLIER 'General case' 0 CA--C 1.521 -0.151 0 CA-C-O 121.098 0.475 . . . . 0.0 110.371 -179.731 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 5.6 tptm -148.73 21.63 1.01 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.138 -179.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 675' ' ' TRP . . . . . 1.114 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 27.5 m95 -56.26 -29.8 61.58 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 121.469 0.652 . . . . 0.0 109.996 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 13.0 m-80 -56.45 -41.5 76.6 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.633 -179.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.39 -51.75 10.29 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -179.309 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 1.02 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -57.32 -39.81 76.6 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.747 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 679' ' ' ALA . . . . . 0.822 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.56 -34.64 70.16 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.45 179.053 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -53.59 -47.78 69.82 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.267 179.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 681' ' ' MET . . . . . 0.67 ' CE ' HD11 ' A' ' 659' ' ' LEU . 0.0 OUTLIER -65.89 -21.55 66.46 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.779 179.306 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 682' ' ' LEU . . . . . 0.473 HD23 ' O ' ' A' ' 678' ' ' LEU . 3.1 mm? -78.28 -2.85 39.94 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.46 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . 0.691 ' C ' HD12 ' A' ' 684' ' ' ILE . 0.5 OUTLIER 71.66 71.79 0.17 Allowed 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.928 0.394 . . . . 0.0 111.251 179.842 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . 0.691 HD12 ' C ' ' A' ' 683' ' ' ARG . 2.1 mp -124.67 135.57 26.81 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.368 179.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -64.92 124.58 13.31 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.563 2.176 . . . . 0.0 112.506 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.79 -17.27 63.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.294 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.42 -24.0 67.09 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.702 0.287 . . . . 0.0 111.237 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 688' ' ' ALA . . . . . 0.423 ' HB3' ' HD3' ' A' ' 691' ' ' ARG . . . -79.31 112.28 16.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.921 0.391 . . . . 0.0 110.873 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -72.39 -68.35 0.48 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.329 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.44 -12.9 0.78 Allowed 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -179.153 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 691' ' ' ARG . . . . . 0.673 ' HG2' HD22 ' A' ' 692' ' ' LEU . 43.5 ptt85 -47.95 -42.79 28.41 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-O 120.919 0.39 . . . . 0.0 111.076 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . 0.673 HD22 ' HG2' ' A' ' 691' ' ' ARG . 2.5 mm? -60.99 -46.95 88.67 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.041 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.28 -39.0 68.67 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.886 0.375 . . . . 0.0 111.242 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 2.4 mttm -64.45 -38.73 92.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.246 179.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 1.114 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.9 OUTLIER -67.09 -44.23 80.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.488 179.756 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.443 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 4.2 mm-40 -55.43 -48.03 75.06 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.011 0.434 . . . . 0.0 110.816 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -76.82 -29.45 55.96 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.01 179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . 0.433 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.35 -37.87 83.93 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.675 -179.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 699' ' ' TYR . . . . . 0.503 ' CZ ' ' HE3' ' A' ' 666' ' ' MET . 1.3 p90 -84.34 -35.08 23.49 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.892 0.377 . . . . 0.0 110.691 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 700' ' ' CYS . . . . . . . . . . . . . 28.8 t -64.86 -30.54 71.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.956 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -98.56 -2.41 38.72 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.581 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 702' ' ' TYR . . . . . 0.433 ' CD1' ' O ' ' A' ' 698' ' ' ALA . 4.8 m-85 -118.44 -78.83 0.59 Allowed 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.85 0.357 . . . . 0.0 111.343 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 90.9 mt -59.82 -40.86 89.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.636 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.424 HD23 ' CD1' ' A' ' 699' ' ' TYR . 0.8 OUTLIER -58.23 -55.34 36.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.92 0.39 . . . . 0.0 111.252 -179.682 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.57 -54.94 34.62 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.046 -179.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 706' ' ' TYR . . . . . 0.414 ' HA ' ' CD1' ' A' ' 709' ' ' LEU . 77.0 t80 -58.4 -50.32 74.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.206 -179.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.78 -27.12 64.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.28 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 18.0 p -79.45 -16.88 55.37 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.178 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 709' ' ' LEU . . . . . 0.847 HD21 ' CE1' ' A' ' 632' ' ' HIS . 63.1 mt -53.37 147.34 10.67 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.935 0.398 . . . . 0.0 111.484 -179.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 710' ' ' SER . . . . . 0.454 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.4 OUTLIER -76.32 169.03 22.88 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.476 179.492 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . 0.454 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 15.9 Cg_endo -57.48 -21.61 46.58 Favored 'Trans proline' 0 C--N 1.345 0.362 0 C-N-CA 122.473 2.115 . . . . 0.0 112.531 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 712' ' ' GLU . . . . . 0.419 ' O ' ' HG3' ' A' ' 715' ' ' ARG . 8.7 pt-20 -70.53 -53.6 15.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.056 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 713' ' ' GLU . . . . . 0.477 ' HB2' ' HB3' ' A' ' 709' ' ' LEU . 5.3 mm-40 -59.17 -26.05 64.44 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.521 -0.308 . . . . 0.0 111.125 -179.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 11.6 m-70 -75.91 -54.25 7.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.038 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 715' ' ' ARG . . . . . 0.419 ' HG3' ' O ' ' A' ' 712' ' ' GLU . 0.0 OUTLIER -64.1 -32.88 74.6 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.654 -179.243 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 7.9 mtt-85 -77.15 -54.22 6.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.926 0.393 . . . . 0.0 111.209 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . 0.494 ' O ' HG23 ' A' ' 721' ' ' VAL . 63.8 mt -62.74 -40.29 96.78 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.802 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . 0.722 ' HG2' HD22 ' A' ' 722' ' ' LEU . 16.8 tt0 -65.24 -54.59 27.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.637 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 719' ' ' LYS . . . . . 0.409 ' CG ' ' O ' ' A' ' 715' ' ' ARG . 0.7 OUTLIER -51.07 -36.76 41.76 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.425 -179.622 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 720' ' ' GLU . . . . . 0.417 ' O ' ' HG2' ' A' ' 723' ' ' MET . 2.3 mt-10 -67.36 -55.78 12.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.977 0.418 . . . . 0.0 110.653 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 721' ' ' VAL . . . . . 0.494 HG23 ' O ' ' A' ' 717' ' ' LEU . 39.5 t -61.92 -54.16 38.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.076 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . 0.722 HD22 ' HG2' ' A' ' 718' ' ' GLU . 4.6 mp -48.95 -45.67 42.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.858 -179.155 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 723' ' ' MET . . . . . 0.615 ' O ' HD12 ' A' ' 727' ' ' ILE . 15.7 ptp -73.11 -42.0 63.41 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 120.464 -0.495 . . . . 0.0 109.859 179.314 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 724' ' ' GLU . . . . . 0.4 ' N ' ' HG3' ' A' ' 723' ' ' MET . 2.2 mm-40 -54.23 -31.24 52.83 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.31 -179.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 725' ' ' LYS . . . . . 0.444 ' HD2' ' CE2' ' A' ' 619' ' ' TRP . 3.5 pttm -86.16 -36.61 19.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.335 -179.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 726' ' ' GLU . . . . . 0.426 ' N ' ' HG3' ' A' ' 725' ' ' LYS . 4.9 mt-10 -71.65 -52.86 15.75 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.911 0.386 . . . . 0.0 111.124 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 727' ' ' ILE . . . . . 0.615 HD12 ' O ' ' A' ' 723' ' ' MET . 3.7 mp -87.63 11.66 1.43 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.68 -179.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.73 -48.96 79.39 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.745 0.307 . . . . 0.0 111.101 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -57.34 -32.46 66.75 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.1 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.197 -0.906 . . . . 0.0 110.884 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 112.587 -0.205 . . . . 0.0 112.587 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_exo -51.91 -53.41 7.03 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.641 2.227 . . . . 0.0 112.285 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.1 mp -71.39 165.58 23.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.919 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . -113.94 63.39 0.3 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.509 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -152.74 109.0 3.38 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.81 0.338 . . . . 0.0 110.924 -179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 9.9 mt -119.17 -178.91 3.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.891 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -99.38 -78.68 1.4 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.516 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.25 -143.07 0.38 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 110.578 -0.156 . . . . 0.0 110.578 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 15.6 mmt85 70.41 147.24 0.07 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.802 0.334 . . . . 0.0 110.698 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 619' ' ' TRP . . . . . 0.462 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.1 OUTLIER -76.55 -6.99 54.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.565 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 122.42 157.9 10.09 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.42 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -68.84 -36.21 14.07 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.549 2.166 . . . . 0.0 112.025 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 54.9 m-80 -71.87 -30.91 65.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.696 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 623' ' ' VAL . . . . . 0.462 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 38.5 t -75.76 -37.49 35.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.617 179.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 624' ' ' GLN . . . . . 0.648 ' CG ' HD11 ' A' ' 722' ' ' LEU . 2.6 tm0? -66.39 -43.49 85.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.578 179.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 6.3 mmt85 -63.43 -50.45 69.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.567 179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 626' ' ' LEU . . . . . 0.505 ' O ' HD23 ' A' ' 626' ' ' LEU . 2.8 tt -61.06 -35.17 76.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.74 179.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . 0.441 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -72.22 -46.06 57.71 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.204 179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -58.39 -46.81 85.65 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.094 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 629' ' ' ILE . . . . . 0.424 HG21 HD23 ' A' ' 653' ' ' LEU . 31.2 mt -66.75 -37.71 80.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.09 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.11 -48.46 81.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.883 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 631' ' ' LYS . . . . . 0.45 ' HD2' HG22 ' A' ' 721' ' ' VAL . 0.8 OUTLIER -63.47 -40.5 97.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.009 -179.945 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 632' ' ' HIS . . . . . 0.621 ' HB2' HD13 ' A' ' 717' ' ' LEU . 67.8 t60 -66.51 -43.78 84.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.829 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.459 HD13 ' SD ' ' A' ' 640' ' ' MET . 49.7 mt -56.38 -49.92 73.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.175 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 634' ' ' ARG . . . . . 0.435 ' HG3' ' N ' ' A' ' 635' ' ' SER . 0.9 OUTLIER -60.82 -40.64 93.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.813 0.339 . . . . 0.0 110.717 179.914 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 635' ' ' SER . . . . . 0.435 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 49.1 m -73.74 -19.52 60.77 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.024 179.578 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 45.5 mm-40 -90.08 -10.46 44.65 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.586 -179.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 119.07 -7.04 12.97 Favored Glycine 0 C--N 1.331 0.298 0 C-N-CA 120.613 -0.804 . . . . 0.0 112.524 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 638' ' ' ILE . . . . . 0.653 ' N ' HD12 ' A' ' 638' ' ' ILE . 3.6 mp -101.18 104.62 16.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.669 0.271 . . . . 0.0 111.143 -179.662 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 1.6 m -78.34 108.14 11.47 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.895 0.379 . . . . 0.0 110.869 179.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 640' ' ' MET . . . . . 0.459 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.9 mtp -122.33 28.61 7.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.98 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -61.0 -31.38 70.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.853 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 51.8 mm-40 -72.39 -78.23 0.09 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.865 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 1.1 pp -177.37 138.54 0.42 Allowed Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.888 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 644' ' ' PRO . . . . . 0.448 ' HB2' HD11 ' A' ' 651' ' ' LEU . 74.2 Cg_endo -75.65 136.92 19.71 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.562 2.175 . . . . 0.0 112.379 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 645' ' ' LEU . . . . . 0.659 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.6 tp -133.75 150.95 51.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.245 0.545 . . . . 0.0 111.267 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 646' ' ' ILE . . . . . 0.61 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.4 tt -149.82 133.93 8.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.702 178.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.15 39.95 58.77 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.319 -0.943 . . . . 0.0 112.429 -179.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.03 7.14 61.86 Favored Glycine 0 C--N 1.333 0.381 0 C-N-CA 120.904 -0.665 . . . . 0.0 113.799 179.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -133.57 164.26 27.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 117.396 0.598 . . . . 0.0 111.374 -179.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 650' ' ' GLU . . . . . 0.659 ' HA ' HD12 ' A' ' 645' ' ' LEU . 3.2 mt-10 -79.33 144.35 34.31 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.748 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 651' ' ' LEU . . . . . 0.624 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.59 144.99 48.25 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.306 -179.745 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 652' ' ' ASP . . . . . 0.493 ' OD1' ' HB3' ' A' ' 654' ' ' ALA . 10.9 t0 -94.81 105.09 17.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.932 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 653' ' ' LEU . . . . . 0.424 HD23 HG21 ' A' ' 629' ' ' ILE . 5.6 mp -53.88 -38.69 65.02 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.975 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 654' ' ' ALA . . . . . 0.493 ' HB3' ' OD1' ' A' ' 652' ' ' ASP . . . -63.57 -43.16 97.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.982 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 1.7 t -69.82 -31.66 69.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.465 179.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 656' ' ' PHE . . . . . 0.534 ' HD2' HD23 ' A' ' 651' ' ' LEU . 0.1 OUTLIER -72.42 -44.66 62.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.827 179.789 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -59.75 -48.47 81.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.843 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.75 -43.3 99.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.112 -179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . 0.688 HD13 ' CD2' ' A' ' 682' ' ' LEU . 0.3 OUTLIER -59.57 -49.38 78.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.404 -179.648 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 660' ' ' ILE . . . . . 0.79 HG23 HG21 ' A' ' 669' ' ' VAL . 85.6 mt -56.75 -45.64 82.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.793 0.33 . . . . 0.0 110.993 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.76 -44.23 86.51 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.109 -179.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -64.16 -32.47 74.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.159 -179.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . 0.467 ' CE ' HG22 ' A' ' 669' ' ' VAL . 1.2 mtm -72.73 -9.6 58.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.479 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 119.27 38.38 0.74 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.339 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 75.93 173.16 34.54 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.718 -0.754 . . . . 0.0 112.428 -179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 666' ' ' MET . . . . . 0.556 ' O ' HG22 ' A' ' 670' ' ' THR . 10.5 tpt -66.45 -41.67 88.77 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.682 0.277 . . . . 0.0 111.366 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 667' ' ' GLN . . . . . 0.427 ' O ' ' HB2' ' A' ' 671' ' ' ASP . 5.6 pt20 -50.37 -46.66 56.1 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -179.157 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 668' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -50.78 69.77 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.887 0.375 . . . . 0.0 111.059 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 669' ' ' VAL . . . . . 0.79 HG21 HG23 ' A' ' 660' ' ' ILE . 48.9 t -55.74 -55.5 17.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.911 -179.748 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 670' ' ' THR . . . . . 0.587 HG23 ' OD1' ' A' ' 671' ' ' ASP . 15.2 t -75.95 -52.45 10.25 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -178.007 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 671' ' ' ASP . . . . . 0.587 ' OD1' HG23 ' A' ' 670' ' ' THR . 0.8 OUTLIER -60.79 -50.97 71.33 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -178.203 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 26.3 mt -76.39 1.61 15.84 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 2.3 mttm 49.86 82.96 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.021 0.439 . . . . 0.0 110.266 -179.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 1.4 ttmp? -142.73 23.73 1.91 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.304 -179.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 675' ' ' TRP . . . . . 1.113 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 37.8 m95 -62.4 -27.64 69.23 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.337 0.589 . . . . 0.0 110.211 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -57.67 -45.48 85.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.482 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.01 -51.61 13.17 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.742 0.306 . . . . 0.0 111.445 -179.382 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.981 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -56.01 -40.55 73.55 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 179.624 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 679' ' ' ALA . . . . . 0.83 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.71 -31.87 67.2 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.496 179.18 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.18 -49.69 71.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.194 179.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 681' ' ' MET . . . . . 0.534 ' CE ' HD11 ' A' ' 659' ' ' LEU . 1.9 ttm -62.38 -21.44 65.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.603 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 682' ' ' LEU . . . . . 0.688 ' CD2' HD13 ' A' ' 659' ' ' LEU . 3.4 mm? -80.55 -1.51 42.28 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.371 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . 0.64 ' C ' HD12 ' A' ' 684' ' ' ILE . 10.3 mmm180 68.84 71.77 0.28 Allowed 'General case' 0 N--CA 1.462 0.126 0 CA-C-O 120.936 0.398 . . . . 0.0 110.861 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . 0.64 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.7 mp -118.78 136.48 24.23 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.926 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.52 123.68 11.43 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.486 2.124 . . . . 0.0 112.272 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -16.85 63.24 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.387 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.29 -23.79 67.12 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.01 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 688' ' ' ALA . . . . . 0.495 ' HB1' ' HB2' ' A' ' 691' ' ' ARG . . . -84.51 106.08 15.81 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.846 0.355 . . . . 0.0 110.95 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -73.17 -68.56 0.48 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.325 -179.576 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -51.97 -19.76 2.0 Allowed 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -179.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 691' ' ' ARG . . . . . 0.495 ' HB2' ' HB1' ' A' ' 688' ' ' ALA . 0.0 OUTLIER -46.2 -39.43 9.74 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.789 0.328 . . . . 0.0 111.223 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -58.61 -45.35 89.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.844 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.11 -37.51 69.51 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.99 179.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.8 -40.85 97.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.224 179.6 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 1.113 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.3 OUTLIER -65.44 -44.31 87.71 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.18 179.499 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.431 ' O ' ' CD2' ' A' ' 699' ' ' TYR . 42.9 tt0 -55.76 -45.88 77.98 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.884 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.25 -29.89 54.23 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.041 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . 0.449 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -66.42 -37.58 85.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.483 -179.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 699' ' ' TYR . . . . . 0.527 ' CZ ' ' HE2' ' A' ' 666' ' ' MET . 1.7 p90 -86.04 -33.92 20.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.074 0.464 . . . . 0.0 110.233 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 700' ' ' CYS . . . . . 0.543 ' HA ' HD23 ' A' ' 704' ' ' LEU . 1.4 m -63.1 -30.53 71.67 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.867 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -100.97 -1.81 33.44 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.478 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 702' ' ' TYR . . . . . 0.554 ' CE2' HG21 ' A' ' 638' ' ' ILE . 4.5 m-85 -117.57 -75.94 0.58 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.94 0.4 . . . . 0.0 111.4 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 20.2 mt -64.27 -41.73 96.78 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.812 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.543 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.4 OUTLIER -47.92 -56.91 6.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.848 0.356 . . . . 0.0 111.431 -179.496 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 1.4 m -54.64 -46.44 73.93 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.27 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 706' ' ' TYR . . . . . 0.608 ' O ' HD22 ' A' ' 709' ' ' LEU . 67.7 t80 -63.43 -29.47 70.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.346 -179.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -96.92 -2.47 43.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.709 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 57.8 m -113.2 -21.57 10.93 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.727 0.298 . . . . 0.0 111.36 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 709' ' ' LEU . . . . . 0.664 ' O ' HD23 ' A' ' 709' ' ' LEU . 0.2 OUTLIER -69.56 171.54 8.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.885 179.981 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -72.66 164.29 61.36 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.008 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.26 -29.88 54.81 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.544 2.163 . . . . 0.0 111.959 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -51.07 -50.81 57.97 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.75 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 713' ' ' GLU . . . . . 0.453 ' HB2' ' CD1' ' A' ' 709' ' ' LEU . 1.6 mm-40 -58.26 -28.21 64.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.935 179.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 714' ' ' HIS . . . . . 0.535 ' CD2' HD21 ' A' ' 709' ' ' LEU . 1.7 m170 -76.02 -54.01 7.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.583 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.68 -44.64 96.56 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.37 -179.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 2.0 mtp-105 -65.66 -54.16 31.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.273 -179.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . 0.621 HD13 ' HB2' ' A' ' 632' ' ' HIS . 76.8 mt -62.98 -41.13 99.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.787 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . 0.65 ' HG3' HD13 ' A' ' 722' ' ' LEU . 30.3 tt0 -66.82 -54.12 25.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.3 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.74 -34.62 27.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.347 -179.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 720' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' A' ' 723' ' ' MET . 6.0 mt-10 -68.54 -55.63 11.04 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.009 0.433 . . . . 0.0 110.428 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 721' ' ' VAL . . . . . 0.45 HG22 ' HD2' ' A' ' 631' ' ' LYS . 44.7 t -61.55 -53.66 45.51 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.808 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . 0.65 HD13 ' HG3' ' A' ' 718' ' ' GLU . 3.6 mp -48.69 -46.43 40.41 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.884 -179.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 723' ' ' MET . . . . . 0.564 ' HB2' HD13 ' A' ' 727' ' ' ILE . 16.5 ptp -71.49 -41.01 69.85 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.566 -0.454 . . . . 0.0 109.873 179.399 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 724' ' ' GLU . . . . . 0.417 ' N ' ' HG3' ' A' ' 723' ' ' MET . 1.9 mm-40 -53.48 -32.8 51.79 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.403 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 725' ' ' LYS . . . . . 0.456 ' HD3' ' CE2' ' A' ' 619' ' ' TRP . 8.7 pttt -86.18 -41.92 14.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.314 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 726' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 722' ' ' LEU . 13.7 mt-10 -66.23 -54.0 30.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.882 0.373 . . . . 0.0 111.147 -179.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 727' ' ' ILE . . . . . 0.631 HG22 ' O ' ' A' ' 727' ' ' ILE . 4.3 mp -86.94 11.51 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.746 -179.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 1.7 tt -57.65 -42.15 82.88 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.817 0.342 . . . . 0.0 111.168 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -59.62 -51.06 71.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.123 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 730' ' ' LYS . . . . . 0.49 ' HD3' HG23 ' A' ' 727' ' ' ILE . 9.4 mtpt . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.861 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.19 0 N-CA-C 112.453 -0.259 . . . . 0.0 112.453 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -68.1 -39.71 10.14 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.569 2.179 . . . . 0.0 112.302 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -71.45 178.11 3.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.88 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 105.36 -83.01 0.35 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.506 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 5.4 p 59.22 108.93 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.849 0.357 . . . . 0.0 110.969 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 6.3 mt -138.98 -169.92 2.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.888 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -122.91 -94.41 1.18 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.492 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 1.6 mmm180 -147.52 121.74 9.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.047 0.451 . . . . 0.0 110.716 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.78 125.38 50.49 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.893 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 619' ' ' TRP . . . . . 0.535 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.0 OUTLIER -61.0 -18.38 57.35 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.29 -179.988 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 120.57 169.14 13.84 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.489 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -68.15 -38.71 11.8 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.59 2.193 . . . . 0.0 112.174 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 622' ' ' ASN . . . . . 0.533 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 59.5 m-80 -62.46 -42.64 99.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.93 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 623' ' ' VAL . . . . . 0.464 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 40.5 t -72.15 -35.01 51.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.845 179.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 624' ' ' GLN . . . . . 0.603 ' CG ' HD11 ' A' ' 722' ' ' LEU . 2.1 tm0? -57.7 -47.32 82.69 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.766 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.69 -43.5 75.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.796 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 626' ' ' LEU . . . . . 0.545 ' O ' HD23 ' A' ' 626' ' ' LEU . 6.2 tt -59.7 -36.93 77.51 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.971 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . 0.455 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -72.77 -46.29 54.17 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.293 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.17 -46.82 82.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.054 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 23.5 mt -66.63 -40.04 85.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.122 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 6.1 ttpt -62.9 -49.41 74.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.905 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 631' ' ' LYS . . . . . 0.478 ' HD2' HG22 ' A' ' 721' ' ' VAL . 2.7 tttm -58.13 -42.57 86.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.036 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 632' ' ' HIS . . . . . 0.74 ' HB2' HD13 ' A' ' 717' ' ' LEU . 79.9 t60 -68.27 -41.92 80.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.974 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.592 HD13 ' SD ' ' A' ' 640' ' ' MET . 39.1 mt -56.04 -47.41 77.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.21 -179.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 1.7 ptt180 -65.43 -41.75 93.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.77 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.78 -13.57 60.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.304 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 636' ' ' GLN . . . . . 0.45 ' CG ' ' CE1' ' A' ' 632' ' ' HIS . 62.4 mm-40 -96.21 -9.46 30.41 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.619 -179.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 118.89 -9.86 12.3 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.595 -0.812 . . . . 0.0 112.371 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 638' ' ' ILE . . . . . 0.638 ' N ' HD12 ' A' ' 638' ' ' ILE . 3.5 mp -98.79 104.75 16.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.708 0.29 . . . . 0.0 111.074 -179.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -80.61 116.08 20.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.963 179.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 640' ' ' MET . . . . . 0.592 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.5 ttp -124.26 16.66 9.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.182 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.79 -31.21 62.43 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.839 0.352 . . . . 0.0 111.036 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -70.91 -73.67 0.17 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.786 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 1.9 pp -179.73 130.77 0.25 Allowed Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.749 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -73.11 124.79 9.81 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.432 2.088 . . . . 0.0 112.287 179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 645' ' ' LEU . . . . . 0.644 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.8 tp -127.36 152.76 47.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.28 0.562 . . . . 0.0 111.323 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 646' ' ' ILE . . . . . 0.483 HG22 ' HB3' ' A' ' 651' ' ' LEU . 4.4 tt -149.65 133.42 8.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.222 -0.899 . . . . 0.0 109.486 178.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 50.71 43.01 46.46 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.25 -0.976 . . . . 0.0 112.212 -179.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 68.86 6.77 53.44 Favored Glycine 0 CA--C 1.52 0.39 0 C-N-CA 121.068 -0.587 . . . . 0.0 113.908 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 62.4 m -130.9 161.97 30.69 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 117.609 0.705 . . . . 0.0 111.636 -179.072 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 650' ' ' GLU . . . . . 0.644 ' HA ' HD12 ' A' ' 645' ' ' LEU . 10.3 mt-10 -80.41 142.57 34.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.759 179.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 651' ' ' LEU . . . . . 0.638 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -135.16 145.3 47.64 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.298 -179.742 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -96.36 111.64 23.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.787 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -51.97 -38.94 58.41 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.029 -179.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 654' ' ' ALA . . . . . 0.533 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -65.04 -44.35 89.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.055 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -68.55 -33.9 74.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.862 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 656' ' ' PHE . . . . . 0.432 ' CE2' ' HG ' ' A' ' 682' ' ' LEU . 0.7 OUTLIER -72.88 -45.16 59.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.853 -179.96 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -61.39 -46.48 89.99 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.725 179.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.96 -45.32 95.21 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.816 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . 0.622 HD12 ' HB2' ' A' ' 678' ' ' LEU . 0.2 OUTLIER -56.62 -48.76 76.79 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.933 -179.975 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 660' ' ' ILE . . . . . 0.746 HG21 ' HG2' ' A' ' 666' ' ' MET . 76.9 mt -58.2 -45.48 88.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.927 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 14.4 m-20 -64.74 -46.54 81.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.231 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -55.38 -40.71 71.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.179 -179.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . 0.401 ' HE1' ' N ' ' A' ' 678' ' ' LEU . 0.0 OUTLIER -65.95 -27.22 68.0 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.028 -179.983 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 131.69 46.98 0.12 Allowed Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.347 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 75.99 176.45 40.81 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.505 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 666' ' ' MET . . . . . 0.746 ' HG2' HG21 ' A' ' 660' ' ' ILE . 0.0 OUTLIER -73.11 -30.58 63.74 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.768 0.318 . . . . 0.0 111.109 -179.975 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 667' ' ' GLN . . . . . 0.423 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 4.3 pt20 -57.25 -45.77 83.67 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.641 -179.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 668' ' ' GLN . . . . . 0.466 ' HA ' HD13 ' A' ' 672' ' ' LEU . 0.0 OUTLIER -66.5 -52.76 42.54 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.838 0.351 . . . . 0.0 111.336 -179.615 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 669' ' ' VAL . . . . . 0.728 HG21 HG23 ' A' ' 660' ' ' ILE . 66.8 t -49.51 -54.97 5.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.572 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 670' ' ' THR . . . . . 0.613 HG22 ' O ' ' A' ' 666' ' ' MET . 12.3 t -76.18 -49.59 16.8 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 -178.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 671' ' ' ASP . . . . . 0.471 ' N ' HG23 ' A' ' 670' ' ' THR . 7.9 t70 -62.95 -51.16 67.96 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -177.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 672' ' ' LEU . . . . . 0.466 HD13 ' HA ' ' A' ' 668' ' ' GLN . 10.7 mp -79.04 3.6 16.85 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -179.04 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 14.7 ttmm 48.56 84.81 0.03 OUTLIER 'General case' 0 C--O 1.231 0.13 0 CA-C-O 120.971 0.415 . . . . 0.0 110.507 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt -145.06 22.9 1.54 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.24 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 675' ' ' TRP . . . . . 1.087 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 39.4 m95 -61.24 -28.63 69.3 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 121.397 0.617 . . . . 0.0 110.112 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 7.2 m-80 -56.9 -43.9 81.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.484 -179.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.14 -51.52 12.0 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.755 0.312 . . . . 0.0 111.44 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.969 HD22 ' HA ' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.59 -40.39 71.98 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 179.645 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 679' ' ' ALA . . . . . 0.835 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.83 -33.61 68.62 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.513 179.074 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.33 -49.5 66.96 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.211 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 19.9 mtm -62.92 -22.62 66.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.67 179.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 682' ' ' LEU . . . . . 0.477 HD23 ' O ' ' A' ' 678' ' ' LEU . 3.5 mm? -79.53 -1.23 36.74 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.333 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . 0.667 ' C ' HD12 ' A' ' 684' ' ' ILE . 0.2 OUTLIER 69.38 71.81 0.25 Allowed 'General case' 0 N--CA 1.462 0.147 0 CA-C-O 120.951 0.405 . . . . 0.0 111.065 -179.83 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . 0.667 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.7 mp -119.81 135.7 24.39 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.72 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.99 123.16 10.9 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.411 2.074 . . . . 0.0 112.375 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -16.4 63.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.167 179.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -65.46 -23.74 66.99 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.12 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 688' ' ' ALA . . . . . 0.422 ' CB ' ' HB2' ' A' ' 691' ' ' ARG . . . -85.25 105.36 15.88 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.834 0.349 . . . . 0.0 111.011 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 -70.32 -68.35 0.43 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.141 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -53.33 -17.8 2.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.909 -179.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 691' ' ' ARG . . . . . 0.61 ' NE ' HG23 ' A' ' 684' ' ' ILE . 0.0 OUTLIER -46.82 -35.25 6.08 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.905 0.383 . . . . 0.0 111.143 179.904 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . 0.413 HD13 ' HA ' ' A' ' 692' ' ' LEU . 3.8 mm? -66.28 -40.74 90.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.869 179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.11 -37.65 69.46 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.889 179.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 20.9 mmtt -64.3 -40.66 96.39 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.173 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 1.087 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.8 OUTLIER -64.83 -44.55 89.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.377 179.545 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.445 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 3.1 mt-30 -55.42 -46.3 76.66 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.815 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.08 -29.63 55.1 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.132 179.888 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -67.49 -38.53 84.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.581 -179.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 699' ' ' TYR . . . . . 0.779 ' HB2' HD12 ' A' ' 703' ' ' LEU . 1.1 p90 -85.69 -31.82 22.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.948 0.404 . . . . 0.0 110.516 179.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 700' ' ' CYS . . . . . 0.43 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 1.6 m -65.77 -30.61 71.29 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.476 179.509 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -97.11 -8.47 30.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.37 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 702' ' ' TYR . . . . . 0.419 ' CE2' HG21 ' A' ' 638' ' ' ILE . 4.0 m-85 -113.47 -78.99 0.58 Allowed 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.829 0.347 . . . . 0.0 111.367 -179.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 703' ' ' LEU . . . . . 0.779 HD12 ' HB2' ' A' ' 699' ' ' TYR . 61.6 mt -56.17 -46.55 79.31 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.618 -179.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.452 HD23 ' CE1' ' A' ' 699' ' ' TYR . 1.0 OUTLIER -53.97 -48.62 70.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.901 0.382 . . . . 0.0 110.887 -179.928 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . 0.638 ' O ' HD13 ' A' ' 709' ' ' LEU . 4.4 m -54.63 -54.97 34.54 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.347 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 706' ' ' TYR . . . . . 0.497 ' CE2' ' CE1' ' A' ' 714' ' ' HIS . 18.4 t80 -46.81 -43.59 18.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.787 -179.678 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -94.49 1.61 55.73 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -179.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 29.7 t -80.56 -20.29 43.74 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -179.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 709' ' ' LEU . . . . . 0.638 HD13 ' O ' ' A' ' 705' ' ' SER . 0.0 OUTLIER -94.62 -174.27 3.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.824 0.345 . . . . 0.0 111.46 -179.768 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 710' ' ' SER . . . . . 0.416 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.4 OUTLIER -85.3 167.06 27.54 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.965 -179.817 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . 0.416 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 18.8 Cg_endo -58.92 -17.86 39.44 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.608 2.205 . . . . 0.0 112.765 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -60.12 -52.75 64.02 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.8 0.333 . . . . 0.0 110.889 179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 713' ' ' GLU . . . . . 0.436 ' O ' HD12 ' A' ' 717' ' ' LEU . 65.9 mm-40 -64.47 -25.88 68.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.955 179.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 714' ' ' HIS . . . . . 0.497 ' CE1' ' CE2' ' A' ' 706' ' ' TYR . 0.1 OUTLIER -74.91 -54.63 6.91 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.171 179.599 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 15.5 mmm180 -65.25 -36.21 83.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.274 -179.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 18.6 mtt180 -65.52 -54.23 31.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.822 0.344 . . . . 0.0 110.993 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . 0.74 HD13 ' HB2' ' A' ' 632' ' ' HIS . 30.5 mt -62.77 -34.84 78.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.694 179.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . 0.703 ' HG2' HD22 ' A' ' 722' ' ' LEU . 27.0 tt0 -69.39 -53.9 17.11 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.394 179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -52.34 -34.09 45.72 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.432 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 720' ' ' GLU . . . . . 0.449 ' O ' ' HG2' ' A' ' 723' ' ' MET . 1.0 OUTLIER -69.35 -55.81 9.33 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.019 0.437 . . . . 0.0 110.389 179.775 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 721' ' ' VAL . . . . . 0.617 HG23 ' O ' ' A' ' 717' ' ' LEU . 21.5 t -61.8 -53.13 52.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.053 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . 0.703 HD22 ' HG2' ' A' ' 718' ' ' GLU . 6.9 mp -51.81 -42.49 62.54 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.009 -179.271 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 723' ' ' MET . . . . . 0.605 ' O ' HD12 ' A' ' 727' ' ' ILE . 14.2 ptp -71.91 -39.71 69.32 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 120.487 -0.485 . . . . 0.0 109.994 179.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 724' ' ' GLU . . . . . 0.416 ' N ' ' HG3' ' A' ' 723' ' ' MET . 1.4 mt-10 -56.29 -32.0 64.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.291 -179.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 725' ' ' LYS . . . . . 0.457 ' HD3' ' CE2' ' A' ' 619' ' ' TRP . 7.5 pttt -86.15 -43.84 12.71 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.298 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -63.96 -48.43 76.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.922 0.392 . . . . 0.0 110.982 -179.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 727' ' ' ILE . . . . . 0.654 HG22 ' O ' ' A' ' 727' ' ' ILE . 4.3 mp -89.46 11.57 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.526 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 1.5 tt -57.69 -34.52 69.51 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.794 0.33 . . . . 0.0 110.959 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -76.88 -53.08 8.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.953 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 3.1 mttt . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.935 179.979 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.161 0 N-CA-C 112.515 -0.234 . . . . 0.0 112.515 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -52.55 -35.46 66.99 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.555 2.17 . . . . 0.0 112.272 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.8 mt -71.96 -175.46 1.45 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.849 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 111.1 -24.66 15.72 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.608 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 8.7 t -94.65 43.88 1.1 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.851 0.357 . . . . 0.0 110.961 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 615' ' ' LEU . . . . . 0.76 HD22 ' NH1' ' A' ' 617' ' ' ARG . 25.9 mt -83.04 169.09 16.31 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.875 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -168.24 54.06 0.22 Allowed Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.525 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . 0.76 ' NH1' HD22 ' A' ' 615' ' ' LEU . 2.3 mpp_? -123.24 -146.0 0.35 Allowed 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 110.433 -0.21 . . . . 0.0 110.433 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.42 117.01 10.5 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.94 0.4 . . . . 0.0 111.038 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 619' ' ' TRP . . . . . 0.435 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.5 OUTLIER -60.75 173.15 0.79 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.813 179.853 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . -55.99 170.58 2.22 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.703 -0.761 . . . . 0.0 112.468 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -65.76 -49.42 2.28 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.509 2.139 . . . . 0.0 112.09 179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 622' ' ' ASN . . . . . 0.584 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 0.1 OUTLIER -58.61 -20.64 49.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.288 -179.938 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 623' ' ' VAL . . . . . 0.435 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 28.9 t -75.7 -45.93 37.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.911 0.386 . . . . 0.0 110.472 179.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.08 -43.81 94.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.163 179.341 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.06 -50.86 71.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.537 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 7.4 tt -62.54 -33.27 74.58 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.949 0.404 . . . . 0.0 110.542 179.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . 0.573 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -69.46 -46.83 65.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.267 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -62.28 -44.64 96.06 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.128 -179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 629' ' ' ILE . . . . . 0.467 ' HA ' ' CD2' ' A' ' 632' ' ' HIS . 14.6 mt -60.54 -45.08 97.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.99 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 630' ' ' LYS . . . . . 0.482 ' HA ' HD12 ' A' ' 633' ' ' LEU . 13.8 ttpt -64.13 -34.32 77.79 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.231 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.36 -48.03 74.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.641 -179.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 632' ' ' HIS . . . . . 0.468 ' HB3' HD13 ' A' ' 717' ' ' LEU . 1.1 p80 -68.53 -37.83 80.34 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.823 0.344 . . . . 0.0 110.558 179.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.489 HD13 ' SD ' ' A' ' 640' ' ' MET . 32.1 mt -55.73 -49.95 71.67 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.121 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 634' ' ' ARG . . . . . 0.408 ' HG3' ' N ' ' A' ' 635' ' ' SER . 4.1 ptt180 -65.25 -40.99 94.71 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.78 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 635' ' ' SER . . . . . 0.408 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 1.4 m -73.75 -13.33 60.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.408 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 636' ' ' GLN . . . . . 0.587 HE22 HD21 ' A' ' 709' ' ' LEU . 0.0 OUTLIER -97.39 -6.56 33.79 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.661 -179.654 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 111.96 4.21 26.11 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.6 -0.809 . . . . 0.0 112.57 179.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 638' ' ' ILE . . . . . . . . . . . . . 17.7 mt -110.77 106.09 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-O 120.72 0.295 . . . . 0.0 111.238 -179.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -85.2 118.4 24.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.892 0.377 . . . . 0.0 110.816 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 640' ' ' MET . . . . . 0.489 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.5 ttp -121.45 23.01 10.54 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.174 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -58.08 -30.61 66.36 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.011 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -71.23 -79.49 0.07 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.853 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -178.36 133.82 0.31 Allowed Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.839 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -77.79 118.24 4.44 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.582 2.188 . . . . 0.0 112.388 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 645' ' ' LEU . . . . . 0.636 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.9 tp -118.58 152.55 35.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.226 0.536 . . . . 0.0 111.181 179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 646' ' ' ILE . . . . . 0.661 HD11 ' HA ' ' A' ' 695' ' ' LEU . 15.8 tt -149.67 133.88 8.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.828 179.218 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 52.28 40.24 52.59 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.363 -0.922 . . . . 0.0 112.239 -179.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.33 8.0 61.49 Favored Glycine 0 C--N 1.333 0.382 0 C-N-CA 120.913 -0.66 . . . . 0.0 113.686 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.2 m -133.51 163.3 29.68 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 117.366 0.583 . . . . 0.0 111.368 -179.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 650' ' ' GLU . . . . . 0.636 ' HA ' HD12 ' A' ' 645' ' ' LEU . 5.0 mt-10 -79.84 144.67 33.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.657 179.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 651' ' ' LEU . . . . . 0.615 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.62 145.07 48.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.352 -179.783 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -97.08 109.76 22.44 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.841 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 653' ' ' LEU . . . . . 0.561 HD12 ' CD2' ' A' ' 651' ' ' LEU . 5.7 mp -52.14 -37.84 55.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.004 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 654' ' ' ALA . . . . . 0.584 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -66.05 -44.05 85.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.174 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 5.7 t -69.9 -36.45 75.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.67 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 656' ' ' PHE . . . . . 0.435 ' CZ ' ' HG ' ' A' ' 682' ' ' LEU . 0.2 OUTLIER -70.93 -45.85 63.49 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.831 179.998 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -57.73 -50.57 72.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.993 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.87 -41.17 95.41 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.989 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . 0.843 HD22 HD23 ' A' ' 682' ' ' LEU . 0.1 OUTLIER -59.0 -49.85 76.33 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.111 -179.794 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 660' ' ' ILE . . . . . 0.783 HG23 HG21 ' A' ' 669' ' ' VAL . 62.8 mt -56.87 -46.14 83.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.767 0.318 . . . . 0.0 110.882 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 2.2 m-80 -61.81 -38.08 86.81 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.016 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 51.6 tt0 -66.69 -14.73 62.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.422 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.16 33.59 1.72 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.824 0.345 . . . . 0.0 111.101 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 72.46 25.16 74.94 Favored Glycine 0 N--CA 1.45 -0.388 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.641 179.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 97.48 169.61 32.93 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.583 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 666' ' ' MET . . . . . 0.507 ' HE2' ' CE1' ' A' ' 699' ' ' TYR . 9.6 tpt -64.82 -37.47 87.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.703 0.287 . . . . 0.0 111.116 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 667' ' ' GLN . . . . . 0.448 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 8.3 pt20 -50.79 -44.13 58.76 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.308 -179.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 668' ' ' GLN . . . . . 0.472 ' HA ' HD13 ' A' ' 672' ' ' LEU . 0.0 OUTLIER -65.85 -52.74 47.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.903 0.382 . . . . 0.0 110.922 179.959 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 669' ' ' VAL . . . . . 0.783 HG21 HG23 ' A' ' 660' ' ' ILE . 48.4 t -49.57 -55.83 4.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.687 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 670' ' ' THR . . . . . 0.511 HG23 ' N ' ' A' ' 671' ' ' ASP . 14.0 t -76.27 -53.67 7.9 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.658 0.984 . . . . 0.0 113.658 -178.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 671' ' ' ASP . . . . . 0.511 ' N ' HG23 ' A' ' 670' ' ' THR . 6.3 t70 -58.56 -51.17 71.03 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -177.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 672' ' ' LEU . . . . . 0.472 HD13 ' HA ' ' A' ' 668' ' ' GLN . 9.1 mp -77.22 1.84 17.27 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -178.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 49.07 83.43 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 121.13 0.49 . . . . 0.0 110.532 -179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.18 22.7 1.36 Allowed 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.646 -0.707 . . . . 0.0 110.981 -179.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 675' ' ' TRP . . . . . 1.121 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 29.3 m95 -58.47 -28.63 65.51 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 121.391 0.615 . . . . 0.0 110.204 179.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 14.8 m-80 -56.11 -41.59 75.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.895 -179.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 6.3 mmtp -77.8 -51.82 9.89 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 120.703 0.287 . . . . 0.0 111.66 -179.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 1.056 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -58.06 -40.86 82.07 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.862 -0.421 . . . . 0.0 109.862 179.689 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 679' ' ' ALA . . . . . 0.801 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.56 -33.76 69.38 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.423 179.028 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.74 -49.07 68.96 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.395 179.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 2.9 ttp -64.57 -22.37 66.95 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.906 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 682' ' ' LEU . . . . . 0.843 HD23 HD22 ' A' ' 659' ' ' LEU . 3.1 mm? -78.3 -2.99 40.7 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.446 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . 0.697 ' C ' HD12 ' A' ' 684' ' ' ILE . 37.7 mmt180 70.02 71.8 0.23 Allowed 'General case' 0 N--CA 1.462 0.157 0 CA-C-O 120.979 0.418 . . . . 0.0 111.497 179.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . 0.697 HD12 ' C ' ' A' ' 683' ' ' ARG . 2.0 mp -122.22 141.9 35.59 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.073 179.401 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . 0.661 ' HD2' HG23 ' A' ' 684' ' ' ILE . 51.3 Cg_endo -69.67 119.42 6.37 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 122.511 2.141 . . . . 0.0 112.655 -179.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 8.3 mmmt -69.87 -21.89 63.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.095 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -65.35 -21.6 66.71 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.389 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 688' ' ' ALA . . . . . 0.758 ' HB3' ' HG2' ' A' ' 691' ' ' ARG . . . -72.58 115.75 12.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.873 0.368 . . . . 0.0 111.007 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 67.0 mm-40 -83.39 5.9 21.93 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.49 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -123.81 -15.19 7.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.946 179.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 691' ' ' ARG . . . . . 0.788 ' HG3' HD22 ' A' ' 692' ' ' LEU . 0.0 OUTLIER -53.42 -33.1 52.68 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-O 120.744 0.307 . . . . 0.0 110.951 -179.609 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . 0.788 HD22 ' HG3' ' A' ' 691' ' ' ARG . 3.2 mm? -70.57 -49.54 46.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.056 179.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.19 -39.65 68.46 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.501 -179.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 6.3 mtpt -64.01 -38.85 92.58 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.033 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 1.121 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 4.0 tp -65.08 -47.32 77.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.827 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.413 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 43.5 mt-30 -55.33 -46.8 76.34 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.105 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -76.95 -29.67 55.69 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.131 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . 0.415 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.97 -37.48 81.58 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.797 -179.506 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 699' ' ' TYR . . . . . 0.539 ' HB2' HD12 ' A' ' 703' ' ' LEU . 1.2 p90 -86.6 -33.5 20.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.032 0.444 . . . . 0.0 110.442 179.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 700' ' ' CYS . . . . . 0.513 ' HA ' HD23 ' A' ' 704' ' ' LEU . 1.8 m -65.78 -30.46 71.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.887 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -98.53 -1.52 40.92 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.549 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 702' ' ' TYR . . . . . 0.415 ' CD1' ' O ' ' A' ' 698' ' ' ALA . 7.6 m-85 -122.55 -75.94 0.59 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.791 0.329 . . . . 0.0 111.308 -179.87 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 703' ' ' LEU . . . . . 0.631 HD13 HD12 ' A' ' 660' ' ' ILE . 19.7 mt -56.0 -44.55 78.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.439 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.513 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.9 OUTLIER -54.84 -27.17 40.3 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.15 -179.91 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . 0.441 ' HB3' ' CE1' ' A' ' 632' ' ' HIS . 0.2 OUTLIER -67.99 -55.52 12.37 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.557 179.901 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 706' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -53.15 -46.62 68.93 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.147 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -74.82 -19.42 60.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.526 -179.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 40.0 t -88.99 -35.21 16.52 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.767 0.318 . . . . 0.0 111.21 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 709' ' ' LEU . . . . . 0.587 HD21 HE22 ' A' ' 636' ' ' GLN . 71.8 mt -56.67 150.06 16.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.184 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 710' ' ' SER . . . . . 0.428 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.5 OUTLIER -75.7 166.82 42.1 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.8 179.953 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . 0.428 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 11.4 Cg_endo -54.8 -26.08 45.99 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.542 2.161 . . . . 0.0 112.334 179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.84 -53.35 58.43 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.747 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 713' ' ' GLU . . . . . 0.457 ' O ' HD12 ' A' ' 717' ' ' LEU . 5.7 mm-40 -60.21 -26.21 66.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.033 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 17.4 m170 -75.83 -54.38 7.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.944 0.402 . . . . 0.0 110.471 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 17.0 mtt180 -60.56 -47.62 85.4 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.461 -179.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.93 -54.17 34.94 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.568 -179.394 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . 0.468 HD13 ' HB3' ' A' ' 632' ' ' HIS . 73.9 mt -62.38 -41.93 99.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.978 -179.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -65.95 -54.25 28.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.836 0.35 . . . . 0.0 110.2 179.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 1.5 mmpt? -50.42 -33.57 21.32 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.331 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 720' ' ' GLU . . . . . 0.426 ' O ' ' HG2' ' A' ' 723' ' ' MET . 12.7 mt-10 -69.25 -55.36 10.76 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.578 179.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 721' ' ' VAL . . . . . 0.573 HG11 ' HB1' ' A' ' 627' ' ' ALA . 25.2 t -64.06 -54.99 24.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.922 -179.828 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . 0.446 ' O ' ' HG3' ' A' ' 725' ' ' LYS . 1.1 mp -49.16 -43.37 41.81 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.724 -179.524 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 723' ' ' MET . . . . . 0.531 ' O ' HD12 ' A' ' 727' ' ' ILE . 8.0 ptp -73.85 -40.48 63.25 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.562 -0.455 . . . . 0.0 109.942 179.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -51.08 -38.06 49.43 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.532 -179.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 725' ' ' LYS . . . . . 0.446 ' HG3' ' O ' ' A' ' 722' ' ' LEU . 0.0 OUTLIER -86.08 -34.78 20.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.732 0.301 . . . . 0.0 111.088 -179.787 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -65.35 -54.33 30.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.026 0.441 . . . . 0.0 110.789 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 727' ' ' ILE . . . . . 0.62 HG22 ' O ' ' A' ' 727' ' ' ILE . 4.1 mp -88.48 11.49 1.65 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.539 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 2.7 tt -59.12 -48.0 83.2 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.833 0.349 . . . . 0.0 111.094 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -60.51 -50.05 75.12 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.097 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 730' ' ' LYS . . . . . 0.405 ' HD2' HG23 ' A' ' 727' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.873 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.191 0 N-CA-C 112.478 -0.249 . . . . 0.0 112.478 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 611' ' ' PRO . . . . . 0.515 ' HG2' HD12 ' A' ' 612' ' ' LEU . 45.1 Cg_endo -68.26 -47.33 1.67 Allowed 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.534 2.156 . . . . 0.0 112.402 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . 0.515 HD12 ' HG2' ' A' ' 611' ' ' PRO . 2.5 mp -73.68 177.3 5.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.85 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 84.04 -71.14 3.03 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.476 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 30.1 t 60.59 91.24 0.06 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.817 0.342 . . . . 0.0 110.902 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 3.6 mt -118.0 163.69 16.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.882 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 59.46 70.83 0.89 Allowed Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.496 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.53 -144.08 0.36 Allowed 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 110.587 -0.153 . . . . 0.0 110.587 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.8 124.38 19.59 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.005 0.431 . . . . 0.0 111.159 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 619' ' ' TRP . . . . . 0.456 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.5 OUTLIER -52.43 178.6 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.779 179.598 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . -66.3 169.48 32.35 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.452 -0.88 . . . . 0.0 111.907 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -64.15 -29.04 64.98 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.365 2.044 . . . . 0.0 111.862 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 46.4 m-80 -63.94 -38.61 91.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.932 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 623' ' ' VAL . . . . . 0.442 ' HB ' ' CG ' ' A' ' 619' ' ' TRP . 41.4 t -73.3 -36.65 49.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.116 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 624' ' ' GLN . . . . . 0.442 ' CG ' HD11 ' A' ' 722' ' ' LEU . 3.0 tm0? -59.41 -48.09 82.97 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.839 -179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.49 -49.41 66.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.024 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 9.6 tt -62.32 -31.19 71.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.063 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . 0.562 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -66.79 -52.16 47.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.3 -179.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 1.3 m -57.14 -53.19 60.9 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.124 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 629' ' ' ILE . . . . . 0.678 HG21 HD23 ' A' ' 653' ' ' LEU . 18.8 mt -58.92 -39.84 78.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.054 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 4.1 tmmm? -59.81 -40.48 88.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.837 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 631' ' ' LYS . . . . . 0.452 ' HD3' HD22 ' A' ' 717' ' ' LEU . 4.8 tttm -66.08 -40.76 91.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.001 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 632' ' ' HIS . . . . . 0.749 ' CE1' HD11 ' A' ' 709' ' ' LEU . 67.3 t60 -68.34 -44.95 74.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.031 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.469 HD21 ' CD2' ' A' ' 702' ' ' TYR . 25.6 mt -56.53 -49.82 73.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.26 -179.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 18.4 ptt180 -61.87 -41.72 98.2 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.841 0.353 . . . . 0.0 110.913 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.63 -19.49 60.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.25 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -89.1 -8.55 53.62 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.646 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 113.3 3.92 24.0 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.39 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 638' ' ' ILE . . . . . 0.429 HG21 ' CE2' ' A' ' 702' ' ' TYR . 17.2 mt -111.5 104.83 17.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-O 120.747 0.308 . . . . 0.0 111.267 -179.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -82.59 110.78 17.98 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.868 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 640' ' ' MET . . . . . 0.428 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.8 ttp -121.11 30.73 6.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.966 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -63.32 -29.81 71.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.873 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 642' ' ' GLU . . . . . 0.556 ' O ' HD12 ' A' ' 643' ' ' LEU . 12.0 mt-10 -71.57 -76.18 0.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.019 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 643' ' ' LEU . . . . . 0.556 HD12 ' O ' ' A' ' 642' ' ' GLU . 0.1 OUTLIER -179.75 139.24 0.32 Allowed Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.846 -179.99 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_endo -77.95 138.52 16.6 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.603 2.202 . . . . 0.0 112.455 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 645' ' ' LEU . . . . . 0.659 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.8 tp -134.9 151.21 50.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.229 0.538 . . . . 0.0 111.121 179.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 646' ' ' ILE . . . . . 0.632 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.2 tt -148.96 132.55 7.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 115.386 -0.824 . . . . 0.0 109.533 178.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 52.26 43.18 56.97 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.3 -0.952 . . . . 0.0 112.21 -179.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 68.71 6.61 51.49 Favored Glycine 0 C--N 1.334 0.453 0 C-N-CA 121.032 -0.604 . . . . 0.0 113.91 179.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 87.0 m -131.51 163.07 28.81 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 117.507 0.654 . . . . 0.0 111.513 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 650' ' ' GLU . . . . . 0.659 ' HA ' HD12 ' A' ' 645' ' ' LEU . 2.7 mt-10 -80.5 143.88 32.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.798 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 651' ' ' LEU . . . . . 0.614 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -135.0 144.93 47.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.344 -179.841 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -94.02 107.99 19.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.971 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 653' ' ' LEU . . . . . 0.678 HD23 HG21 ' A' ' 629' ' ' ILE . 7.2 mp -54.32 -42.89 70.67 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.997 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -61.44 -46.68 89.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.013 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 1.1 t -66.79 -35.6 80.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.743 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 656' ' ' PHE . . . . . 0.425 ' CZ ' ' HG ' ' A' ' 682' ' ' LEU . 0.2 OUTLIER -70.68 -42.46 70.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.887 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -59.78 -52.04 67.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.039 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 16.9 ttt180 -59.97 -43.41 95.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.093 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . 0.477 HD13 HD21 ' A' ' 682' ' ' LEU . 0.1 OUTLIER -56.84 -43.32 80.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.024 -179.845 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 660' ' ' ILE . . . . . 0.718 HG23 HG21 ' A' ' 669' ' ' VAL . 89.4 mt -64.26 -43.61 97.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.736 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -64.17 -45.89 86.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.052 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -61.23 -21.0 63.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.178 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.81 8.77 21.4 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.503 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 98.87 25.64 9.59 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.638 -0.792 . . . . 0.0 112.644 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 92.0 174.8 42.48 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.561 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 666' ' ' MET . . . . . 0.683 ' HG2' HG21 ' A' ' 660' ' ' ILE . 0.0 OUTLIER -69.66 -25.69 64.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.661 0.267 . . . . 0.0 111.09 179.863 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 667' ' ' GLN . . . . . 0.404 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 15.9 pt20 -59.1 -48.51 81.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.797 -179.358 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 668' ' ' GLN . . . . . 0.442 ' HG3' HD22 ' A' ' 672' ' ' LEU . 0.0 OUTLIER -64.82 -52.81 54.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.897 0.379 . . . . 0.0 111.225 -179.483 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 669' ' ' VAL . . . . . 0.718 HG21 HG23 ' A' ' 660' ' ' ILE . 57.5 t -49.54 -55.35 4.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.681 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 670' ' ' THR . . . . . 0.659 HG22 ' O ' ' A' ' 666' ' ' MET . 10.6 t -76.44 -48.53 19.38 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 -178.176 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 671' ' ' ASP . . . . . 0.456 ' N ' HG23 ' A' ' 670' ' ' THR . 5.0 t70 -66.31 -51.08 60.93 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -177.649 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 672' ' ' LEU . . . . . 0.442 HD22 ' HG3' ' A' ' 668' ' ' GLN . 11.1 mp -77.52 3.83 12.6 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -179.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 48.92 84.18 0.03 OUTLIER 'General case' 0 C--O 1.231 0.125 0 CA-C-O 120.936 0.398 . . . . 0.0 110.446 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 62.1 tttt -145.65 22.16 1.46 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.327 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 675' ' ' TRP . . . . . 1.109 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 34.9 m95 -61.13 -28.91 69.45 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 121.381 0.61 . . . . 0.0 110.125 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 14.6 m-80 -56.02 -43.43 77.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.546 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.41 -51.61 11.5 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 120.687 0.28 . . . . 0.0 111.538 -179.279 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.979 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.01 -41.21 71.0 Favored 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 179.738 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 679' ' ' ALA . . . . . 0.827 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.55 -34.66 70.19 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.743 179.346 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -53.23 -48.54 68.08 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.452 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 3.9 ttm -63.81 -21.56 66.49 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.702 179.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 682' ' ' LEU . . . . . 0.477 HD21 HD13 ' A' ' 659' ' ' LEU . 2.2 mm? -80.48 -1.87 43.49 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.402 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . 0.752 ' C ' HD12 ' A' ' 684' ' ' ILE . 0.3 OUTLIER 71.23 71.74 0.18 Allowed 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 120.887 0.375 . . . . 0.0 111.293 179.95 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . 0.752 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.7 mp -120.57 137.16 25.93 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.626 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . 0.427 ' HD2' HG23 ' A' ' 684' ' ' ILE . 41.8 Cg_endo -67.51 123.91 11.38 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.47 2.113 . . . . 0.0 112.328 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 686' ' ' LYS . . . . . 0.428 ' HE3' HG23 ' A' ' 687' ' ' THR . 0.7 OUTLIER -69.94 -13.7 62.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.412 -179.968 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 687' ' ' THR . . . . . 0.428 HG23 ' HE3' ' A' ' 686' ' ' LYS . 1.5 p -65.34 -22.28 66.8 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.748 0.309 . . . . 0.0 111.253 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 688' ' ' ALA . . . . . 0.453 ' CB ' ' HB2' ' A' ' 691' ' ' ARG . . . -88.46 100.16 12.83 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.889 0.376 . . . . 0.0 110.937 179.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 13.1 mp0 -68.53 -67.56 0.46 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.289 -179.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -52.81 -19.26 2.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.872 -179.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 691' ' ' ARG . . . . . 0.658 HH22 HD22 ' A' ' 695' ' ' LEU . 0.0 OUTLIER -45.39 -42.04 9.76 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 120.783 0.325 . . . . 0.0 111.347 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . 0.428 HD13 ' HA ' ' A' ' 692' ' ' LEU . 3.6 mm? -56.58 -42.69 79.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.955 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.99 -37.18 69.9 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.79 179.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 1.3 ttpp -64.62 -40.23 95.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.241 179.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 1.109 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.4 OUTLIER -65.13 -44.08 89.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.254 179.517 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.461 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 2.0 mt-30 -55.48 -45.96 76.94 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.798 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -77.16 -29.66 54.59 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.073 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . 0.412 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.63 -39.03 84.66 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.599 -179.796 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 699' ' ' TYR . . . . . 0.461 ' CD2' ' CZ2' ' A' ' 675' ' ' TRP . 1.3 p90 -84.72 -32.78 23.33 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.88 0.371 . . . . 0.0 110.488 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 700' ' ' CYS . . . . . 0.472 ' HA ' HD23 ' A' ' 704' ' ' LEU . 32.6 t -66.03 -30.62 71.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.721 179.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -97.65 -2.07 42.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.329 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 702' ' ' TYR . . . . . 0.469 ' CD2' HD21 ' A' ' 633' ' ' LEU . 6.8 m-85 -121.61 -74.83 0.6 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.869 0.366 . . . . 0.0 111.245 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 703' ' ' LEU . . . . . 0.471 ' CD2' HD12 ' A' ' 660' ' ' ILE . 1.7 tp -58.37 -48.4 80.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.589 -179.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.472 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.6 OUTLIER -50.17 -47.62 54.38 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.861 0.362 . . . . 0.0 111.481 -179.663 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.66 -55.19 32.29 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.128 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 706' ' ' TYR . . . . . 0.513 ' CD1' HD12 ' A' ' 709' ' ' LEU . 57.9 t80 -66.78 -29.7 69.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.276 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -76.29 -18.82 58.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.43 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 36.6 p -95.87 -14.65 23.0 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.703 0.287 . . . . 0.0 111.437 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 709' ' ' LEU . . . . . 0.749 HD11 ' CE1' ' A' ' 632' ' ' HIS . 70.2 mt -56.46 151.12 13.83 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.939 0.4 . . . . 0.0 111.358 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 710' ' ' SER . . . . . 0.418 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.6 OUTLIER -78.76 169.73 19.38 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.603 179.66 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . 0.418 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 55.7 Cg_endo -70.06 -12.83 33.07 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.519 2.146 . . . . 0.0 112.851 -179.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -75.47 -56.78 4.37 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.847 0.356 . . . . 0.0 111.109 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 713' ' ' GLU . . . . . 0.699 ' CD ' HD22 ' A' ' 709' ' ' LEU . 0.0 OUTLIER -68.93 -25.41 64.56 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.689 179.939 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 714' ' ' HIS . . . . . 0.406 ' CE1' ' CE2' ' A' ' 706' ' ' TYR . 0.4 OUTLIER -70.03 -54.79 11.61 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.298 -0.41 . . . . 0.0 109.921 179.361 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 2.2 tpt180 -60.65 -40.31 91.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.056 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 27.6 ttp180 -65.33 -53.78 38.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.091 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . 0.591 HD12 ' HG3' ' A' ' 713' ' ' GLU . 47.1 mt -60.45 -41.48 94.18 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.795 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . 0.729 ' HG3' HD13 ' A' ' 722' ' ' LEU . 41.7 tt0 -66.99 -54.15 24.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.441 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.8 -31.6 27.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.482 -179.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 720' ' ' GLU . . . . . 0.425 ' O ' ' HG2' ' A' ' 723' ' ' MET . 18.4 mm-40 -72.06 -55.39 7.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.006 0.431 . . . . 0.0 110.514 179.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 721' ' ' VAL . . . . . 0.562 HG11 ' HB1' ' A' ' 627' ' ' ALA . 40.2 t -62.6 -54.6 31.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.757 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . 0.729 HD13 ' HG3' ' A' ' 718' ' ' GLU . 7.0 mp -53.6 -40.81 66.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.852 -179.389 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 723' ' ' MET . . . . . 0.722 ' O ' HD12 ' A' ' 727' ' ' ILE . 8.2 ptp -71.34 -39.15 71.52 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.024 179.551 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 724' ' ' GLU . . . . . 0.426 ' N ' ' HG3' ' A' ' 723' ' ' MET . 6.6 mm-40 -57.92 -31.32 66.68 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.119 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 725' ' ' LYS . . . . . 0.448 ' HD3' ' NE1' ' A' ' 619' ' ' TRP . 11.4 pttt -86.12 -34.45 20.62 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.443 -179.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 726' ' ' GLU . . . . . 0.409 ' N ' ' HG3' ' A' ' 725' ' ' LYS . 3.5 mm-40 -73.5 -47.55 40.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.282 -179.529 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 727' ' ' ILE . . . . . 0.722 HD12 ' O ' ' A' ' 723' ' ' MET . 4.0 mp -88.16 11.6 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.635 -179.789 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 3.2 tt -64.41 -35.75 81.92 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.817 0.341 . . . . 0.0 110.837 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 16.9 mt-10 -58.64 -43.6 89.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.985 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 1.7 mtmt . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.858 -179.992 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.155 0 N-CA-C 112.538 -0.225 . . . . 0.0 112.538 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.91 -32.45 17.93 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.569 2.179 . . . . 0.0 112.343 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.32 156.16 39.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.892 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 164.85 149.34 5.78 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.51 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -112.74 31.1 6.61 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.813 0.339 . . . . 0.0 110.912 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 25.0 mt -95.26 -179.08 4.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.86 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -143.21 78.08 0.27 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.479 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 17.5 mmt85 -118.29 -144.88 0.37 Allowed 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 110.479 -0.193 . . . . 0.0 110.479 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.76 135.93 33.4 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.861 0.362 . . . . 0.0 111.024 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 619' ' ' TRP . . . . . 0.454 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.1 OUTLIER -66.67 -13.95 61.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.387 179.967 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 124.29 165.08 12.12 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.363 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -70.6 -41.93 2.88 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.596 2.197 . . . . 0.0 112.461 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 622' ' ' ASN . . . . . 0.413 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 7.1 p30 -66.75 -30.93 71.27 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.01 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 623' ' ' VAL . . . . . 0.454 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 55.5 t -74.96 -40.8 45.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-O 120.917 0.389 . . . . 0.0 110.442 179.391 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 624' ' ' GLN . . . . . . . . . . . . . 35.7 tp60 -65.09 -34.59 78.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.951 179.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 81.6 mtm-85 -64.7 -50.72 65.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.248 179.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 626' ' ' LEU . . . . . 0.825 ' O ' HD13 ' A' ' 626' ' ' LEU . 2.0 tm? -62.02 -32.14 72.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.691 179.592 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -74.04 -53.92 8.96 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.744 -179.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 25.0 p -57.07 -42.38 80.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.24 -179.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 629' ' ' ILE . . . . . 0.595 HG22 ' CD1' ' A' ' 633' ' ' LEU . 55.4 mt -68.68 -40.48 81.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.882 0.373 . . . . 0.0 110.732 179.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 2.5 ttpt -62.0 -46.57 88.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.718 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 5.3 tttm -65.18 -40.52 94.37 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.088 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 632' ' ' HIS . . . . . 0.452 ' CE1' HD13 ' A' ' 709' ' ' LEU . 79.3 t60 -68.85 -44.85 72.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.084 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.613 HD13 ' SD ' ' A' ' 640' ' ' MET . 35.6 mt -56.21 -49.91 72.75 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.308 -179.623 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -62.73 -42.29 99.59 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.997 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.74 -16.1 61.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.299 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 636' ' ' GLN . . . . . 0.443 ' CG ' ' CE1' ' A' ' 632' ' ' HIS . 67.8 mm-40 -92.67 -9.12 42.0 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.563 -179.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 114.41 0.33 23.52 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.374 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 638' ' ' ILE . . . . . 0.555 HD11 ' OE1' ' A' ' 701' ' ' GLN . 11.4 mt -108.16 105.41 18.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 CA-C-O 120.767 0.318 . . . . 0.0 111.254 -179.531 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.29 109.82 17.58 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.851 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 640' ' ' MET . . . . . 0.613 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.7 mtp -118.16 28.71 8.21 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.961 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.88 -38.15 90.01 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.903 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -60.96 -76.4 0.05 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.997 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 643' ' ' LEU . . . . . 0.543 HD13 ' HD2' ' A' ' 644' ' ' PRO . 0.2 OUTLIER -178.74 123.28 0.24 Allowed Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.761 179.949 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 644' ' ' PRO . . . . . 0.543 ' HD2' HD13 ' A' ' 643' ' ' LEU . 29.6 Cg_endo -63.26 139.95 74.73 Favored 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.488 2.125 . . . . 0.0 112.33 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 645' ' ' LEU . . . . . 0.659 HD12 ' HA ' ' A' ' 650' ' ' GLU . 5.0 tp -142.01 153.2 44.09 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.269 0.557 . . . . 0.0 111.223 179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 646' ' ' ILE . . . . . 0.51 HD11 ' HA ' ' A' ' 695' ' ' LEU . 3.2 tt -149.84 133.76 8.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 CA-C-N 115.196 -0.911 . . . . 0.0 109.466 178.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 49.72 43.43 37.99 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.192 -1.004 . . . . 0.0 111.98 -179.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 68.48 6.02 46.7 Favored Glycine 0 CA--C 1.521 0.427 0 C-N-CA 121.149 -0.548 . . . . 0.0 113.972 179.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.3 m -129.58 160.89 31.87 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 117.586 0.693 . . . . 0.0 111.697 -178.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 650' ' ' GLU . . . . . 0.659 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.9 OUTLIER -78.9 140.62 38.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.824 179.856 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 651' ' ' LEU . . . . . 0.632 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.63 144.92 48.14 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.14 -179.979 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -96.86 111.65 23.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.866 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 653' ' ' LEU . . . . . 0.4 ' HB2' ' CD2' ' A' ' 626' ' ' LEU . 3.4 mm? -54.62 -37.77 66.01 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.89 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 654' ' ' ALA . . . . . 0.413 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -63.91 -46.0 86.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.893 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 33.8 t -66.71 -35.43 80.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.646 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 656' ' ' PHE . . . . . 0.405 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.3 OUTLIER -70.53 -44.58 67.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.783 179.852 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 36.2 t80 -58.01 -43.26 86.56 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.73 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -66.1 -43.59 86.8 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.692 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . 0.675 HD21 ' HE2' ' A' ' 681' ' ' MET . 0.1 OUTLIER -56.68 -52.39 65.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.215 -179.844 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 660' ' ' ILE . . . . . 0.721 HG23 HG21 ' A' ' 669' ' ' VAL . 57.1 mt -57.87 -45.19 87.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.049 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -64.61 -44.27 91.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.396 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -55.13 -22.9 18.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.412 -179.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 12.6 mtm -95.49 35.91 1.3 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.853 0.358 . . . . 0.0 110.845 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 88.23 -50.8 3.91 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.354 -179.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 665' ' ' GLY . . . . . 0.413 ' O ' HG23 ' A' ' 669' ' ' VAL . . . 171.76 -174.73 45.23 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 121.025 -0.607 . . . . 0.0 111.914 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 666' ' ' MET . . . . . 0.587 ' O ' HG22 ' A' ' 670' ' ' THR . 11.1 tpt -73.08 -30.35 63.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.872 0.368 . . . . 0.0 110.899 179.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -57.65 -49.1 77.6 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.412 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 668' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.66 -52.7 62.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.858 0.361 . . . . 0.0 111.294 -179.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 669' ' ' VAL . . . . . 0.721 HG21 HG23 ' A' ' 660' ' ' ILE . 56.4 t -49.31 -55.41 4.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.792 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 670' ' ' THR . . . . . 0.587 HG22 ' O ' ' A' ' 666' ' ' MET . 14.1 t -76.09 -49.64 16.87 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 -178.284 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 671' ' ' ASP . . . . . 0.465 ' N ' HG23 ' A' ' 670' ' ' THR . 63.8 m-20 -61.97 -51.07 69.57 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 -177.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 9.1 mp -78.93 5.2 12.14 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 48.87 83.63 0.04 OUTLIER 'General case' 0 C--O 1.231 0.122 0 CA-C-O 120.994 0.426 . . . . 0.0 110.535 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 14.8 mttm -142.46 22.98 2.0 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.188 -179.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 675' ' ' TRP . . . . . 1.111 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 37.7 m95 -61.44 -27.62 68.69 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-O 121.358 0.599 . . . . 0.0 110.221 179.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 9.9 m-80 -57.3 -45.57 84.02 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.705 -0.679 . . . . 0.0 111.613 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.45 -51.63 12.58 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 120.703 0.287 . . . . 0.0 111.587 -179.355 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.975 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -54.9 -40.64 70.02 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 179.759 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 679' ' ' ALA . . . . . 0.849 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.78 -33.9 68.99 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.602 179.312 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -53.22 -50.37 64.88 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.417 179.622 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 681' ' ' MET . . . . . 0.675 ' HE2' HD21 ' A' ' 659' ' ' LEU . 2.8 mtp -62.11 -19.88 63.46 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.78 179.301 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 682' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -84.71 -1.5 56.27 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.384 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . 0.758 ' C ' HD12 ' A' ' 684' ' ' ILE . 23.3 mmm-85 70.86 71.69 0.19 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-O 120.946 0.403 . . . . 0.0 111.029 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . 0.758 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.6 mp -121.1 137.47 26.71 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.654 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . 0.418 ' HD2' HG23 ' A' ' 684' ' ' ILE . 38.9 Cg_endo -67.09 121.84 9.06 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.391 2.06 . . . . 0.0 112.381 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.91 -18.95 63.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.269 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -65.37 -22.15 66.77 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.241 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 688' ' ' ALA . . . . . 0.432 ' HB1' ' HG3' ' A' ' 691' ' ' ARG . . . -84.53 105.23 15.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.977 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 20.0 mp0 -70.12 -68.61 0.41 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.164 -179.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 12.2 p-10 -51.73 -20.69 2.25 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.798 -179.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 691' ' ' ARG . . . . . 0.438 ' CZ ' HG13 ' A' ' 684' ' ' ILE . 0.0 OUTLIER -47.98 -36.4 12.59 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.865 0.364 . . . . 0.0 111.121 179.873 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -65.38 -45.72 82.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.898 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.02 -37.9 69.69 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.855 179.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.92 -39.64 94.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.08 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 1.111 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.2 OUTLIER -65.95 -42.15 90.34 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.135 179.408 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.432 ' O ' ' CD1' ' A' ' 699' ' ' TYR . 23.5 mt-30 -57.48 -44.09 84.6 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.786 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -77.31 -30.0 53.93 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.157 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . 0.424 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -66.6 -37.75 85.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.442 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 699' ' ' TYR . . . . . 0.554 ' CE2' ' HE2' ' A' ' 666' ' ' MET . 1.8 p90 -86.54 -34.91 19.81 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.108 0.48 . . . . 0.0 109.961 179.388 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 700' ' ' CYS . . . . . 0.453 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 52.4 t -61.01 -30.59 70.39 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.617 179.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 701' ' ' GLN . . . . . 0.555 ' OE1' HD11 ' A' ' 638' ' ' ILE . 0.3 OUTLIER -99.75 -3.4 32.91 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.351 179.921 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 702' ' ' TYR . . . . . 0.496 ' CZ ' HG21 ' A' ' 638' ' ' ILE . 4.8 m-85 -115.47 -77.16 0.57 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.882 0.372 . . . . 0.0 111.366 -179.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 703' ' ' LEU . . . . . 0.411 ' CD2' HD12 ' A' ' 660' ' ' ILE . 1.9 tp -63.6 -40.63 97.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.662 -179.266 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.545 HD23 ' CE2' ' A' ' 699' ' ' TYR . 0.5 OUTLIER -54.06 -50.63 66.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.902 0.382 . . . . 0.0 111.207 -179.68 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -54.3 -54.6 38.08 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.897 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 706' ' ' TYR . . . . . 0.565 ' O ' HD22 ' A' ' 709' ' ' LEU . 20.4 t80 -57.78 -28.87 64.38 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.415 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -96.99 -1.82 44.79 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -106.82 -20.82 13.22 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.584 0.23 . . . . 0.0 111.602 -179.436 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 709' ' ' LEU . . . . . 0.565 HD22 ' O ' ' A' ' 706' ' ' TYR . 0.2 OUTLIER -77.54 176.15 9.19 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.799 0.333 . . . . 0.0 110.97 -179.846 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.16 164.98 57.38 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.158 -179.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -66.68 -28.93 43.85 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.653 2.235 . . . . 0.0 112.102 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -48.86 -48.75 41.71 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.702 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 713' ' ' GLU . . . . . 0.516 ' HB2' HD11 ' A' ' 709' ' ' LEU . 3.5 mm-40 -61.34 -26.38 67.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.059 179.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -76.04 -54.28 7.09 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.989 0.423 . . . . 0.0 110.322 179.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.31 -43.27 96.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.336 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -65.61 -53.96 34.4 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.824 0.345 . . . . 0.0 111.168 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . 0.451 ' O ' HG23 ' A' ' 721' ' ' VAL . 76.2 mt -62.25 -42.12 99.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.092 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 12.6 tt0 -68.84 -54.21 17.01 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.47 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 6.4 mmtt -50.81 -31.85 18.26 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.106 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 720' ' ' GLU . . . . . 0.428 ' O ' ' HG2' ' A' ' 723' ' ' MET . 13.1 mt-10 -70.96 -55.5 8.22 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.497 179.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 721' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 717' ' ' LEU . 35.4 t -63.2 -54.84 27.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.872 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -52.9 -41.11 64.08 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.942 -179.263 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 723' ' ' MET . . . . . 0.583 ' HB2' HD13 ' A' ' 727' ' ' ILE . 15.4 ptp -73.92 -40.72 62.91 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 120.664 -0.414 . . . . 0.0 110.066 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -54.54 -40.73 68.95 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.312 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 725' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.13 -37.56 18.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.289 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.65 -57.28 8.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.875 0.369 . . . . 0.0 111.029 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 727' ' ' ILE . . . . . 0.632 HG22 ' O ' ' A' ' 727' ' ' ILE . 4.1 mp -88.19 11.64 1.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.676 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 728' ' ' LEU . . . . . 0.484 ' O ' HD23 ' A' ' 728' ' ' LEU . 1.8 tt -52.22 -41.63 62.89 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.827 0.346 . . . . 0.0 111.159 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -76.4 -59.91 2.57 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.934 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 13.2 mtmt . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.236 -0.888 . . . . 0.0 110.891 -179.966 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.166 0 N-CA-C 112.513 -0.235 . . . . 0.0 112.513 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -52.38 -29.71 40.25 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.616 2.211 . . . . 0.0 112.31 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.2 mt -79.33 -178.1 6.06 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.9 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 140.47 67.65 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.467 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 32.5 t -133.44 31.62 3.72 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.788 0.327 . . . . 0.0 110.876 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 12.0 mt -91.31 -176.6 4.61 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.891 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 109.0 104.06 2.88 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.538 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -135.44 121.52 20.06 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-O 121.246 0.546 . . . . 0.0 110.763 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.27 136.74 40.06 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.026 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 619' ' ' TRP . . . . . 0.491 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.0 OUTLIER -60.81 -18.48 55.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.248 179.995 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 124.41 165.24 12.14 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.484 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -68.0 -35.38 20.5 Favored 'Trans proline' 0 C--N 1.343 0.27 0 C-N-CA 122.575 2.184 . . . . 0.0 112.222 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 622' ' ' ASN . . . . . 0.577 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 11.0 p30 -66.65 -39.36 88.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.852 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 623' ' ' VAL . . . . . 0.453 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 41.2 t -72.95 -40.84 60.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.77 179.613 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 624' ' ' GLN . . . . . 0.688 ' CG ' HD11 ' A' ' 722' ' ' LEU . 3.2 tm0? -58.0 -41.42 83.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.641 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 625' ' ' ARG . . . . . 0.414 ' O ' HD12 ' A' ' 629' ' ' ILE . 0.0 OUTLIER -68.03 -47.7 67.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.67 179.85 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 626' ' ' LEU . . . . . 0.629 ' O ' HD23 ' A' ' 626' ' ' LEU . 5.6 tt -62.22 -32.92 73.65 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.004 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -73.92 -50.01 22.12 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.273 -179.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.08 -47.14 81.73 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.056 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 629' ' ' ILE . . . . . 0.619 HG21 HD23 ' A' ' 653' ' ' LEU . 12.1 mt -65.42 -41.22 90.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.046 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 9.4 ttpt -61.7 -50.98 70.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.797 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 7.2 tttm -56.58 -41.0 76.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.168 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 632' ' ' HIS . . . . . 0.686 ' HB2' HD13 ' A' ' 717' ' ' LEU . 80.7 t60 -70.97 -43.29 68.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.309 -179.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.482 HD13 ' SD ' ' A' ' 640' ' ' MET . 48.1 mt -56.28 -48.01 77.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.166 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 634' ' ' ARG . . . . . 0.402 ' HG3' ' N ' ' A' ' 635' ' ' SER . 38.3 ptt180 -66.04 -41.07 91.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.813 0.34 . . . . 0.0 110.626 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 635' ' ' SER . . . . . 0.402 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 0.1 OUTLIER -73.76 -11.56 60.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.184 179.638 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -98.74 -7.73 27.2 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.605 -0.271 . . . . 0.0 111.659 -179.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 115.52 -0.01 21.89 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.508 -0.853 . . . . 0.0 112.542 179.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 638' ' ' ILE . . . . . . . . . . . . . 14.5 mt -109.4 104.71 17.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.662 0.268 . . . . 0.0 111.223 -179.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -77.92 113.55 15.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.829 0.347 . . . . 0.0 110.964 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 640' ' ' MET . . . . . 0.482 ' SD ' HD13 ' A' ' 633' ' ' LEU . 2.0 ttp -123.73 31.49 5.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.859 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.7 -33.72 71.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.934 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 642' ' ' GLU . . . . . 0.612 ' HB3' HD23 ' A' ' 643' ' ' LEU . 18.4 mt-10 -70.28 -78.33 0.07 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.893 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 643' ' ' LEU . . . . . 0.612 HD23 ' HB3' ' A' ' 642' ' ' GLU . 2.0 pt? -177.59 132.53 0.34 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.877 179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 644' ' ' PRO . . . . . 0.41 ' HB2' HD11 ' A' ' 651' ' ' LEU . 95.4 Cg_endo -79.67 135.3 11.47 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.531 2.154 . . . . 0.0 112.284 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 645' ' ' LEU . . . . . 0.586 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.6 tp -129.09 152.42 48.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.237 0.542 . . . . 0.0 111.216 179.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 646' ' ' ILE . . . . . 0.672 HD11 ' HA ' ' A' ' 695' ' ' LEU . 4.2 tt -149.74 133.95 8.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.921 179.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.41 38.85 58.38 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.362 -0.923 . . . . 0.0 112.198 -179.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.14 8.01 64.18 Favored Glycine 0 C--N 1.332 0.335 0 C-N-CA 120.981 -0.628 . . . . 0.0 113.71 179.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.3 m -134.38 164.18 28.01 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 117.341 0.571 . . . . 0.0 111.43 -179.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 650' ' ' GLU . . . . . 0.586 ' HA ' HD12 ' A' ' 645' ' ' LEU . 13.2 mt-10 -79.98 146.0 32.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.833 179.858 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 651' ' ' LEU . . . . . 0.612 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.54 144.93 48.28 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.381 -179.824 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -96.91 109.8 22.44 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.859 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 653' ' ' LEU . . . . . 0.619 HD23 HG21 ' A' ' 629' ' ' ILE . 6.8 mp -54.17 -35.96 62.86 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.284 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 654' ' ' ALA . . . . . 0.577 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -65.59 -43.47 89.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.109 -179.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -73.01 -34.73 66.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.61 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 656' ' ' PHE . . . . . 0.451 ' CZ ' ' HG ' ' A' ' 682' ' ' LEU . 0.2 OUTLIER -70.92 -47.98 56.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.801 179.866 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -58.71 -52.81 64.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.098 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 2.6 ptm85 -59.1 -40.14 84.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.853 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . 0.522 HD23 HD12 ' A' ' 678' ' ' LEU . 0.6 OUTLIER -60.47 -48.78 80.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.332 -179.704 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 660' ' ' ILE . . . . . 0.628 HG23 HG21 ' A' ' 669' ' ' VAL . 29.2 mt -56.71 -45.22 82.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-O 120.834 0.349 . . . . 0.0 110.561 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -63.96 -39.79 94.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.915 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 12.1 tp10 -74.48 -13.9 60.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.486 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -94.24 36.63 1.13 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.716 0.294 . . . . 0.0 111.164 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 73.64 31.57 60.44 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.365 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 665' ' ' GLY . . . . . 0.513 ' O ' HG23 ' A' ' 669' ' ' VAL . . . 82.47 173.15 48.83 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.365 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 666' ' ' MET . . . . . 0.49 ' HE1' ' HB ' ' A' ' 669' ' ' VAL . 0.0 OUTLIER -71.17 -40.55 71.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.738 0.304 . . . . 0.0 111.062 179.985 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -52.57 -43.77 65.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.453 -179.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 668' ' ' GLN . . . . . 0.416 ' HG3' HD11 ' A' ' 672' ' ' LEU . 0.0 OUTLIER -64.81 -40.86 95.9 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.935 0.398 . . . . 0.0 110.832 179.937 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 669' ' ' VAL . . . . . 0.628 HG21 HG23 ' A' ' 660' ' ' ILE . 58.7 t -57.88 -55.82 19.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.434 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 670' ' ' THR . . . . . 0.497 HG23 ' N ' ' A' ' 671' ' ' ASP . 8.8 t -75.98 -53.88 7.71 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -178.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 671' ' ' ASP . . . . . 0.497 ' N ' HG23 ' A' ' 670' ' ' THR . 19.2 t0 -54.21 -50.97 65.88 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -178.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 672' ' ' LEU . . . . . 0.416 HD11 ' HG3' ' A' ' 668' ' ' GLN . 25.0 mt -77.77 -1.75 32.95 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.025 0.38 . . . . 0.0 112.025 -179.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 24.4 mttt 49.46 82.7 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 121.09 0.471 . . . . 0.0 110.433 -179.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 40.0 mttt -146.31 22.47 1.34 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.926 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 675' ' ' TRP . . . . . 1.106 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 31.9 m95 -57.24 -31.02 65.11 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-O 121.445 0.64 . . . . 0.0 110.073 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -56.84 -40.79 76.72 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.411 -179.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.52 -51.62 10.42 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 120.776 0.322 . . . . 0.0 111.409 -179.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.987 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -57.48 -37.4 72.86 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.591 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 679' ' ' ALA . . . . . 0.875 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.48 -37.54 71.29 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.429 179.284 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -53.09 -46.29 68.57 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.314 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 35.0 mtp -65.24 -24.51 67.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.564 179.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 682' ' ' LEU . . . . . 0.454 HD23 ' O ' ' A' ' 678' ' ' LEU . 3.3 mm? -78.15 -2.07 35.73 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.535 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . 0.667 ' C ' HD12 ' A' ' 684' ' ' ILE . 1.6 mpp_? 68.68 71.79 0.28 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-O 120.883 0.373 . . . . 0.0 111.401 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . 0.667 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.9 mp -124.25 137.53 29.26 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.352 179.525 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . 0.402 ' HD2' HG23 ' A' ' 684' ' ' ILE . 24.8 Cg_endo -62.04 116.08 3.24 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.332 2.022 . . . . 0.0 112.298 -179.821 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.16 -20.19 66.33 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.95 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 12.7 p -67.65 -23.87 65.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.204 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 688' ' ' ALA . . . . . 0.611 ' HB3' ' HG2' ' A' ' 691' ' ' ARG . . . -64.64 111.02 2.55 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.986 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 19.9 mm-40 -83.06 4.85 24.48 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.559 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -121.78 -16.64 7.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.65 179.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 691' ' ' ARG . . . . . 0.818 ' HG3' HD22 ' A' ' 692' ' ' LEU . 2.3 ppt_? -52.66 -32.07 40.37 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.473 -179.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . 0.818 HD22 ' HG3' ' A' ' 691' ' ' ARG . 2.7 mm? -70.51 -54.54 11.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.729 0.299 . . . . 0.0 111.488 -179.785 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.78 -39.03 70.19 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.406 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 694' ' ' LYS . . . . . 0.406 ' O ' ' HB2' ' A' ' 698' ' ' ALA . 0.7 OUTLIER -63.55 -37.36 87.01 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.979 0.419 . . . . 0.0 109.98 179.442 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 1.106 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 3.9 tp -65.54 -47.76 74.77 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.854 179.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.432 ' HA ' ' CD2' ' A' ' 699' ' ' TYR . 14.7 tt0 -55.19 -47.8 74.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.254 -179.621 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -77.2 -29.81 54.46 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.247 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . 0.417 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.78 -37.06 81.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.754 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 699' ' ' TYR . . . . . 0.482 ' CZ ' ' HE3' ' A' ' 666' ' ' MET . 1.4 p90 -86.28 -34.95 20.21 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.008 0.432 . . . . 0.0 110.361 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 700' ' ' CYS . . . . . 0.412 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 1.7 m -64.23 -30.57 71.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.784 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 25.0 tt0 -97.3 -3.44 40.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.451 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 702' ' ' TYR . . . . . 0.417 ' CD1' ' O ' ' A' ' 698' ' ' ALA . 5.6 m-85 -117.42 -78.59 0.58 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.824 0.345 . . . . 0.0 111.315 -179.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 703' ' ' LEU . . . . . 0.544 HD13 HD12 ' A' ' 660' ' ' ILE . 77.9 mt -58.29 -45.78 87.32 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.532 -179.535 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.471 HD23 ' CE1' ' A' ' 699' ' ' TYR . 1.1 mm? -55.25 -49.05 73.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.919 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . 0.64 ' O ' HD13 ' A' ' 709' ' ' LEU . 2.2 m -54.68 -55.68 27.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.299 179.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 706' ' ' TYR . . . . . 0.442 ' O ' HD21 ' A' ' 709' ' ' LEU . 14.3 t80 -47.44 -38.63 13.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.689 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -96.89 0.28 48.84 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -81.35 -19.71 42.19 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 709' ' ' LEU . . . . . 0.64 HD13 ' O ' ' A' ' 705' ' ' SER . 0.0 OUTLIER -92.27 -176.64 4.41 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.002 0.43 . . . . 0.0 111.458 -179.599 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 710' ' ' SER . . . . . 0.445 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.6 OUTLIER -84.7 168.59 20.19 Favored Pre-proline 0 C--N 1.331 -0.208 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.997 -179.804 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . 0.445 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 19.0 Cg_endo -59.01 -19.37 47.98 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.596 2.198 . . . . 0.0 112.569 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -59.36 -52.41 65.73 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.764 0.316 . . . . 0.0 110.73 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 713' ' ' GLU . . . . . 0.447 ' HB2' ' HG ' ' A' ' 709' ' ' LEU . 4.8 mm-40 -64.19 -25.69 68.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.842 179.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -74.42 -54.7 7.06 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.094 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -65.19 -34.78 79.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.394 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.08 -53.97 25.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.75 0.309 . . . . 0.0 111.045 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . 0.686 HD13 ' HB2' ' A' ' 632' ' ' HIS . 43.8 mt -65.4 -36.73 84.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.055 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . 0.581 ' HG2' HD22 ' A' ' 722' ' ' LEU . 37.2 tt0 -71.7 -54.22 11.02 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.482 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 2.5 mmtm -54.55 -30.91 55.39 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.207 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 720' ' ' GLU . . . . . 0.447 ' O ' ' HG2' ' A' ' 723' ' ' MET . 3.4 mm-40 -71.56 -55.8 7.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.991 0.424 . . . . 0.0 110.508 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 721' ' ' VAL . . . . . 0.539 HG23 ' O ' ' A' ' 717' ' ' LEU . 42.3 t -62.8 -50.75 78.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.915 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . 0.688 HD11 ' CG ' ' A' ' 624' ' ' GLN . 9.4 mp -56.93 -37.97 72.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.89 -179.24 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 723' ' ' MET . . . . . 0.551 ' O ' HD12 ' A' ' 727' ' ' ILE . 13.7 ptp -74.16 -39.13 63.46 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.26 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 724' ' ' GLU . . . . . 0.427 ' N ' ' HG3' ' A' ' 723' ' ' MET . 3.8 mt-10 -60.52 -31.0 70.09 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.057 -179.783 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 725' ' ' LYS . . . . . 0.417 ' HD2' ' CE2' ' A' ' 619' ' ' TRP . 9.5 pttt -86.09 -41.04 15.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.304 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -69.97 -50.6 40.17 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.155 -179.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 727' ' ' ILE . . . . . 0.784 HG23 ' HE3' ' A' ' 730' ' ' LYS . 4.2 mp -88.13 11.61 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.631 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 2.5 tt -57.8 -45.49 85.99 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.808 0.337 . . . . 0.0 111.058 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -60.7 -56.24 23.6 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.985 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 730' ' ' LYS . . . . . 0.784 ' HE3' HG23 ' A' ' 727' ' ' ILE . 28.5 mtmt . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.878 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 112.533 -0.227 . . . . 0.0 112.533 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -72.92 -35.11 5.8 Favored 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 122.591 2.194 . . . . 0.0 112.289 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 35.7 mt -65.25 159.99 22.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.963 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . -166.85 -51.85 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.408 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 61.25 94.66 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.817 0.341 . . . . 0.0 110.983 179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 7.2 mt -100.35 -175.9 3.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.824 179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -170.84 -104.77 0.18 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.618 -0.801 . . . . 0.0 112.59 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . 0.419 ' O ' ' HG2' ' A' ' 617' ' ' ARG . 0.0 OUTLIER -123.04 118.23 27.26 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-O 121.503 0.668 . . . . 0.0 110.879 -179.73 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.82 144.45 48.98 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.868 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 619' ' ' TRP . . . . . 0.457 ' CE2' ' HD2' ' A' ' 725' ' ' LYS . 0.1 OUTLIER -74.59 -7.05 51.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.43 179.969 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 116.63 158.25 11.24 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.438 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.81 -37.62 15.44 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.589 2.193 . . . . 0.0 112.048 179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 622' ' ' ASN . . . . . 0.632 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 18.4 m-80 -67.73 -33.54 75.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.73 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 623' ' ' VAL . . . . . 0.451 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 60.5 t -70.15 -42.59 79.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.59 179.591 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 624' ' ' GLN . . . . . 0.406 ' OE1' HD12 ' A' ' 722' ' ' LEU . 42.6 tp60 -62.92 -38.11 89.66 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.46 179.609 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.37 -49.63 74.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.395 179.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 9.8 tt -67.7 -28.55 67.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.828 179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -73.86 -49.21 26.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.139 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -58.81 -48.15 82.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.026 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 629' ' ' ILE . . . . . 0.55 HG22 HD11 ' A' ' 633' ' ' LEU . 20.5 mt -65.28 -38.84 83.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.984 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 630' ' ' LYS . . . . . 0.421 ' HA ' HD12 ' A' ' 633' ' ' LEU . 0.0 OUTLIER -62.02 -47.26 85.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.893 179.98 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -63.63 -40.22 96.34 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.984 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 632' ' ' HIS . . . . . 0.51 ' HB2' HD13 ' A' ' 717' ' ' LEU . 75.8 t60 -67.85 -42.89 80.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.858 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.598 HD13 ' SD ' ' A' ' 640' ' ' MET . 13.7 mt -56.58 -49.93 73.43 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.13 -179.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -61.47 -41.54 97.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.67 179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 11.8 t -73.56 -16.88 61.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.158 179.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -93.72 -9.58 37.23 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.57 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 119.95 -10.08 11.19 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.582 -0.818 . . . . 0.0 112.576 179.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 638' ' ' ILE . . . . . 0.65 ' N ' HD12 ' A' ' 638' ' ' ILE . 3.3 mp -98.96 104.67 16.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 120.733 0.302 . . . . 0.0 111.114 -179.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 1.2 m -77.18 113.12 14.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.889 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 640' ' ' MET . . . . . 0.598 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.9 mtp -128.37 31.01 5.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.887 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -62.89 -39.3 94.08 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.937 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -66.95 -77.83 0.07 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.001 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -176.43 140.96 0.53 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.839 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 644' ' ' PRO . . . . . 0.517 ' HB2' HD11 ' A' ' 651' ' ' LEU . 87.1 Cg_endo -78.23 147.95 23.71 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.604 2.203 . . . . 0.0 112.499 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 645' ' ' LEU . . . . . 0.689 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.8 tp -141.36 150.9 43.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.201 0.524 . . . . 0.0 111.159 179.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 646' ' ' ILE . . . . . 0.593 HD11 ' HA ' ' A' ' 695' ' ' LEU . 0.8 OUTLIER -149.58 132.99 7.54 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.634 179.004 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.04 41.02 59.43 Favored Glycine 0 N--CA 1.449 -0.448 0 C-N-CA 120.339 -0.934 . . . . 0.0 112.176 -179.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 69.96 6.91 58.14 Favored Glycine 0 C--N 1.333 0.373 0 C-N-CA 120.969 -0.634 . . . . 0.0 113.786 179.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.8 m -131.23 162.13 30.69 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 117.372 0.586 . . . . 0.0 111.512 -179.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 650' ' ' GLU . . . . . 0.689 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.1 OUTLIER -77.92 144.04 37.18 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.773 179.775 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 651' ' ' LEU . . . . . 0.597 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -135.39 145.11 46.99 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.098 0.475 . . . . 0.0 111.296 -179.638 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -96.93 110.75 23.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.897 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 653' ' ' LEU . . . . . 0.415 HD13 ' HA ' ' A' ' 653' ' ' LEU . 3.5 mm? -52.19 -30.15 25.72 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.976 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 654' ' ' ALA . . . . . 0.632 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -71.69 -44.64 63.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.044 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 4.2 t -69.36 -34.42 74.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.547 179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 656' ' ' PHE . . . . . 0.444 ' HD2' HD23 ' A' ' 651' ' ' LEU . 0.2 OUTLIER -71.29 -47.02 59.37 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.778 179.847 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 657' ' ' PHE . . . . . 0.457 ' HD1' HD21 ' A' ' 703' ' ' LEU . 89.4 t80 -56.83 -50.89 71.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.841 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 5.9 mtm180 -60.2 -41.63 93.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.718 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.66 -48.33 75.2 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.98 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 660' ' ' ILE . . . . . 0.742 HG21 ' HG2' ' A' ' 666' ' ' MET . 14.0 mt -59.94 -44.64 94.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.827 179.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 13.4 t30 -61.02 -44.43 97.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.888 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -67.14 -13.95 62.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.352 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 36.5 mmm -94.57 36.49 1.16 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.776 0.322 . . . . 0.0 111.102 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 65.04 44.24 94.64 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.588 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 81.51 172.73 47.21 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.549 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 666' ' ' MET . . . . . 0.742 ' HG2' HG21 ' A' ' 660' ' ' ILE . 0.0 OUTLIER -73.01 -31.66 64.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.744 0.307 . . . . 0.0 111.123 179.919 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 667' ' ' GLN . . . . . 0.405 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 12.6 pt20 -56.94 -44.09 82.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.185 -179.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 668' ' ' GLN . . . . . 0.415 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -64.87 -52.15 58.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.956 0.408 . . . . 0.0 110.842 -179.901 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 669' ' ' VAL . . . . . 0.654 HG21 HG23 ' A' ' 660' ' ' ILE . 80.4 t -49.25 -55.77 3.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.619 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 670' ' ' THR . . . . . 0.534 HG22 ' O ' ' A' ' 666' ' ' MET . 14.5 t -76.28 -50.29 14.76 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -178.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 671' ' ' ASP . . . . . 0.481 ' N ' HG23 ' A' ' 670' ' ' THR . 6.1 t0 -63.32 -51.25 66.79 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -177.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 672' ' ' LEU . . . . . 0.415 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 10.5 mp -76.68 2.68 13.48 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -178.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 48.89 85.62 0.03 OUTLIER 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.987 0.423 . . . . 0.0 110.494 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 16.5 mttt -147.13 22.07 1.21 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.209 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 675' ' ' TRP . . . . . 1.152 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 38.1 m95 -60.15 -27.47 67.11 Favored 'General case' 0 N--CA 1.455 -0.203 0 CA-C-O 121.358 0.599 . . . . 0.0 110.16 179.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -55.44 -44.36 76.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.63 -0.714 . . . . 0.0 111.714 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 12.1 mttm -77.08 -51.6 10.76 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 120.748 0.309 . . . . 0.0 111.539 -179.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 1.012 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.43 -40.94 72.15 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 109.786 -0.449 . . . . 0.0 109.786 179.694 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 679' ' ' ALA . . . . . 0.827 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.62 -35.06 70.33 Favored 'General case' 0 C--N 1.334 -0.073 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.828 179.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -53.21 -47.64 68.78 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.504 179.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -19.19 65.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.066 179.628 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 682' ' ' LEU . . . . . 0.495 HD23 ' O ' ' A' ' 678' ' ' LEU . 3.2 mm? -80.99 -2.8 49.35 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.632 -179.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . 0.771 ' C ' HD12 ' A' ' 684' ' ' ILE . 8.4 mmm180 73.68 71.88 0.12 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.869 0.366 . . . . 0.0 111.465 179.678 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . 0.771 HD12 ' C ' ' A' ' 683' ' ' ARG . 3.2 mp -134.25 138.46 30.41 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.323 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . 0.542 ' HD2' HG23 ' A' ' 684' ' ' ILE . 28.1 Cg_endo -63.0 125.35 15.7 Favored 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.498 2.132 . . . . 0.0 112.763 -179.514 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -69.96 -23.9 63.25 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.023 179.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.36 -23.93 67.11 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.289 -179.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -71.34 109.16 5.17 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.826 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -70.79 -68.88 0.4 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.971 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -52.52 -18.53 1.75 Allowed 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 691' ' ' ARG . . . . . 0.439 ' HD3' HD22 ' A' ' 692' ' ' LEU . 0.0 OUTLIER -50.25 -33.96 21.48 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.795 0.331 . . . . 0.0 110.779 179.764 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . 0.439 HD22 ' HD3' ' A' ' 691' ' ' ARG . 4.3 mm? -70.27 -48.04 58.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.913 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.1 -38.41 69.36 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.316 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 2.7 tptt -61.71 -40.63 95.7 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.088 0.47 . . . . 0.0 110.117 179.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 1.152 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.3 OUTLIER -66.89 -43.79 82.54 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.399 179.551 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.49 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 5.2 tp60 -55.42 -46.91 76.63 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.76 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -77.18 -29.37 54.37 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.753 179.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . 0.429 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -68.1 -40.58 82.57 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.64 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 699' ' ' TYR . . . . . 0.498 ' CD2' ' CZ2' ' A' ' 675' ' ' TRP . 0.7 OUTLIER -84.16 -31.13 25.32 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.955 0.407 . . . . 0.0 110.657 -179.94 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 700' ' ' CYS . . . . . 0.451 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 41.7 t -67.69 -30.4 69.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.877 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -101.14 -1.78 33.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.787 -179.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 702' ' ' TYR . . . . . 0.439 ' CE2' HG21 ' A' ' 638' ' ' ILE . 4.3 m-85 -115.55 -78.85 0.58 Allowed 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.809 0.337 . . . . 0.0 111.7 -179.508 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 703' ' ' LEU . . . . . 0.457 HD21 ' HD1' ' A' ' 657' ' ' PHE . 2.7 tp -63.2 -38.85 92.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.829 -179.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.451 ' HB2' ' O ' ' A' ' 700' ' ' CYS . 0.6 OUTLIER -50.83 -56.66 11.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.471 -179.557 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 22.7 p -54.42 -49.32 70.23 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.173 -179.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 706' ' ' TYR . . . . . 0.637 ' O ' HD22 ' A' ' 709' ' ' LEU . 10.5 t80 -62.36 -29.14 70.25 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.345 -179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -96.8 -1.27 46.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.823 -179.563 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 1.5 t -112.31 -18.18 12.56 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.603 0.239 . . . . 0.0 111.501 -179.656 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 709' ' ' LEU . . . . . 0.637 HD22 ' O ' ' A' ' 706' ' ' TYR . 0.2 OUTLIER -74.09 175.19 7.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.759 0.314 . . . . 0.0 110.992 -179.918 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.44 166.15 47.4 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.228 -179.761 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -67.94 -27.45 36.69 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.646 2.23 . . . . 0.0 112.119 179.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -52.2 -50.51 61.79 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.633 179.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 713' ' ' GLU . . . . . 0.462 ' HB2' ' CD1' ' A' ' 709' ' ' LEU . 3.3 mm-40 -58.08 -26.6 62.76 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.193 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 714' ' ' HIS . . . . . 0.581 ' CD2' HD21 ' A' ' 709' ' ' LEU . 5.6 m170 -75.88 -53.62 8.17 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.935 0.398 . . . . 0.0 110.61 179.732 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 4.4 tpp180 -59.78 -45.32 92.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.385 -179.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -54.23 31.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.443 -179.452 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . 0.51 HD13 ' HB2' ' A' ' 632' ' ' HIS . 71.2 mt -62.04 -44.06 97.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.816 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -64.72 -53.78 41.83 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.164 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 6.7 mmtt -50.15 -34.22 21.63 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.152 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 720' ' ' GLU . . . . . 0.437 ' O ' ' HG2' ' A' ' 723' ' ' MET . 1.1 mm-40 -68.16 -55.47 12.25 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.012 0.434 . . . . 0.0 110.404 179.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 721' ' ' VAL . . . . . . . . . . . . . 31.3 t -62.84 -54.98 26.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.977 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . 0.406 HD12 ' OE1' ' A' ' 624' ' ' GLN . 1.2 mp -49.0 -43.76 40.52 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.765 -179.312 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 723' ' ' MET . . . . . 0.698 ' O ' HD12 ' A' ' 727' ' ' ILE . 17.4 ptp -73.6 -41.31 63.01 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 120.456 -0.498 . . . . 0.0 109.792 179.416 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -57.37 -29.47 64.06 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.461 -179.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 725' ' ' LYS . . . . . 0.457 ' HD2' ' CE2' ' A' ' 619' ' ' TRP . 9.4 ptmm? -86.02 -38.88 17.42 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.329 -179.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 726' ' ' GLU . . . . . 0.403 ' N ' ' HG3' ' A' ' 725' ' ' LYS . 1.7 mm-40 -71.3 -49.92 37.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.017 -179.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 727' ' ' ILE . . . . . 0.698 HD12 ' O ' ' A' ' 723' ' ' MET . 3.7 mp -88.36 11.45 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.629 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 1.6 tt -58.77 -49.48 77.49 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.824 0.345 . . . . 0.0 110.94 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -71.89 -46.1 58.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 10.3 mtpt . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.217 -0.897 . . . . 0.0 110.878 -179.965 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.234 0 N-CA-C 112.502 -0.239 . . . . 0.0 112.502 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -68.91 -27.96 30.03 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.589 2.193 . . . . 0.0 112.269 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 6.9 mt -66.26 168.21 9.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.92 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 73.4 44.98 31.81 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.487 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -158.27 60.54 0.45 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.859 0.361 . . . . 0.0 110.868 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 7.1 mt -77.63 170.91 15.75 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.869 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . 0.404 ' O ' ' HD3' ' A' ' 617' ' ' ARG . . . 111.76 70.59 0.59 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.492 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . 0.404 ' HD3' ' O ' ' A' ' 616' ' ' GLY . 76.2 mmt-85 -139.24 120.65 14.98 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.164 0.507 . . . . 0.0 110.572 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.7 126.28 5.6 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.927 179.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 619' ' ' TRP . . . . . 0.535 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.0 OUTLIER -63.09 -17.43 62.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.183 179.95 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 119.0 166.12 13.36 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.495 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_endo -67.54 -36.49 19.64 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.508 2.139 . . . . 0.0 112.127 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 74.5 m-20 -65.01 -42.17 94.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.842 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 623' ' ' VAL . . . . . 0.458 HG21 ' HB2' ' A' ' 619' ' ' TRP . 47.4 t -68.53 -37.09 77.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.926 179.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 624' ' ' GLN . . . . . 0.509 ' CG ' HD21 ' A' ' 722' ' ' LEU . 6.3 tm0? -62.1 -41.81 98.59 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.8 179.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.64 -47.03 76.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.679 179.808 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 7.1 tt -67.07 -26.62 66.82 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.96 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . 0.475 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -73.95 -54.06 8.74 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.363 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 30.8 p -57.92 -41.83 83.51 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.03 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 29.0 mt -69.28 -42.52 81.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.816 179.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.48 -43.87 98.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.765 179.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 1.6 tttm -63.01 -42.21 99.78 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.852 179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 632' ' ' HIS . . . . . 0.64 ' HB2' HD13 ' A' ' 717' ' ' LEU . 77.8 t60 -67.41 -42.4 83.29 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.898 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.644 HD13 ' SD ' ' A' ' 640' ' ' MET . 58.0 mt -55.9 -49.48 73.3 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.338 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 634' ' ' ARG . . . . . 0.49 ' HG3' ' N ' ' A' ' 635' ' ' SER . 0.0 OUTLIER -64.22 -40.44 96.05 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.937 -179.972 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 635' ' ' SER . . . . . 0.49 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 0.1 OUTLIER -73.89 -16.09 61.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.142 179.765 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 636' ' ' GLN . . . . . 0.444 ' CG ' ' CE1' ' A' ' 632' ' ' HIS . 14.0 mm-40 -94.44 -10.23 33.07 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.564 -179.669 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 120.22 -11.97 10.58 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 120.573 -0.822 . . . . 0.0 112.522 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 638' ' ' ILE . . . . . 0.456 HG21 ' CE2' ' A' ' 702' ' ' TYR . 5.3 mp -94.25 104.7 16.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 120.668 0.27 . . . . 0.0 111.194 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -81.42 109.08 15.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.844 0.354 . . . . 0.0 110.994 179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 640' ' ' MET . . . . . 0.644 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.4 mtp -119.13 28.89 7.98 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.891 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -66.68 -31.84 72.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.888 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -72.73 -78.61 0.09 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.878 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 1.3 pp -178.87 126.79 0.26 Allowed Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.947 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -75.54 131.03 13.26 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.459 2.106 . . . . 0.0 112.274 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 645' ' ' LEU . . . . . 0.445 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.1 tp -126.43 152.47 46.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.206 0.527 . . . . 0.0 111.13 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 646' ' ' ILE . . . . . 0.664 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.2 tt -149.57 133.26 8.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.832 179.174 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 54.15 38.87 62.27 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.239 -0.981 . . . . 0.0 111.93 -179.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.45 7.55 60.97 Favored Glycine 0 CA--C 1.52 0.389 0 C-N-CA 121.085 -0.579 . . . . 0.0 113.626 179.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 11.0 m -133.82 164.15 27.9 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 117.366 0.583 . . . . 0.0 111.557 -179.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 650' ' ' GLU . . . . . 0.445 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.2 OUTLIER -78.92 145.75 33.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.761 179.694 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 651' ' ' LEU . . . . . 0.613 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.94 145.05 47.8 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.406 -179.745 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -96.9 111.76 23.82 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.984 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 653' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 653' ' ' LEU . 3.8 mm? -53.06 -35.49 59.6 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.097 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -67.88 -46.19 72.35 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.231 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 4.7 t -69.15 -38.22 78.66 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.608 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 656' ' ' PHE . . . . . 0.48 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.3 OUTLIER -68.73 -47.25 66.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.892 179.813 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -60.33 -50.97 71.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.011 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -56.03 -43.44 77.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.102 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . 0.825 HD13 ' CD2' ' A' ' 682' ' ' LEU . 0.2 OUTLIER -57.68 -47.55 82.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.17 -179.782 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 660' ' ' ILE . . . . . 0.695 HG23 HG21 ' A' ' 669' ' ' VAL . 24.7 mt -56.87 -45.09 83.25 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.8 0.333 . . . . 0.0 110.825 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -62.41 -44.97 95.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.726 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -66.84 -14.13 62.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.251 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . 0.404 ' CE ' ' HB3' ' A' ' 678' ' ' LEU . 0.0 OUTLIER -94.93 36.44 1.2 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.718 0.294 . . . . 0.0 110.979 -179.913 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 68.97 35.65 79.51 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.658 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 84.02 172.46 48.94 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.542 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 666' ' ' MET . . . . . 0.632 ' O ' HG22 ' A' ' 670' ' ' THR . 9.0 tpt -70.99 -28.94 64.8 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.66 0.267 . . . . 0.0 111.041 -179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 667' ' ' GLN . . . . . 0.442 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 12.4 pt20 -57.21 -43.74 83.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.25 -179.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 668' ' ' GLN . . . . . 0.431 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -66.63 -52.69 42.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.941 0.4 . . . . 0.0 110.913 179.979 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 669' ' ' VAL . . . . . 0.695 HG21 HG23 ' A' ' 660' ' ' ILE . 53.2 t -49.37 -55.65 3.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.627 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 670' ' ' THR . . . . . 0.632 HG22 ' O ' ' A' ' 666' ' ' MET . 14.9 t -76.39 -48.89 18.26 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 113.857 1.058 . . . . 0.0 113.857 -178.474 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 671' ' ' ASP . . . . . 0.458 ' N ' HG23 ' A' ' 670' ' ' THR . 17.5 t0 -65.65 -51.22 61.25 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -177.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 672' ' ' LEU . . . . . 0.431 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 8.7 mp -76.92 3.24 12.56 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 -179.154 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 49.22 84.47 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 120.962 0.41 . . . . 0.0 110.426 -179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 1.9 ttmt -144.72 21.86 1.63 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.263 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 675' ' ' TRP . . . . . 1.149 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 36.3 m95 -60.26 -28.52 68.13 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.369 0.604 . . . . 0.0 110.089 179.694 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -55.64 -44.51 77.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.643 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 1.7 ttpt -76.85 -51.55 11.09 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 120.704 0.287 . . . . 0.0 111.634 -179.3 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 1.006 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.56 -41.84 73.83 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 179.798 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 679' ' ' ALA . . . . . 0.79 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.48 -34.18 69.94 Favored 'General case' 0 C--N 1.334 -0.1 0 CA-C-O 120.875 0.369 . . . . 0.0 110.521 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.34 -46.35 69.47 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.389 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 4.9 ttm -65.52 -21.05 66.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.837 179.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 682' ' ' LEU . . . . . 0.825 ' CD2' HD13 ' A' ' 659' ' ' LEU . 2.7 mm? -79.96 -1.4 39.34 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.428 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . 0.795 ' C ' HD12 ' A' ' 684' ' ' ILE . 1.8 mpt_? 72.1 71.85 0.16 Allowed 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 120.959 0.409 . . . . 0.0 111.37 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . 0.795 HD12 ' C ' ' A' ' 683' ' ' ARG . 3.1 mp -133.57 138.28 30.78 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.328 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . 0.525 ' HD2' HG23 ' A' ' 684' ' ' ILE . 21.7 Cg_endo -61.68 125.3 16.36 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.591 2.194 . . . . 0.0 112.679 -179.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.86 -26.03 64.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.954 179.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.52 -23.84 66.98 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.224 -179.817 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -68.96 109.15 3.8 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.517 -0.31 . . . . 0.0 110.916 179.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -71.74 -68.93 0.42 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.889 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -51.4 -21.28 2.2 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.771 -179.578 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 691' ' ' ARG . . . . . 0.503 ' NH2' ' HB3' ' A' ' 679' ' ' ALA . 0.0 OUTLIER -49.87 -35.22 22.6 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.881 0.372 . . . . 0.0 110.687 179.677 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . 0.448 HD22 ' NE ' ' A' ' 691' ' ' ARG . 4.5 mm? -70.41 -47.21 61.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.074 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.13 -39.14 69.04 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.451 -179.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 7.1 mttp -61.87 -41.32 97.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.09 0.471 . . . . 0.0 110.255 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 1.149 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.4 OUTLIER -67.32 -43.91 80.46 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.471 179.784 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.443 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 1.3 tt0 -55.24 -46.22 76.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.87 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -77.56 -29.69 52.31 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.074 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . 0.42 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.38 -39.25 85.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.544 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 699' ' ' TYR . . . . . 0.528 ' CZ ' ' HE2' ' A' ' 666' ' ' MET . 1.0 OUTLIER -84.99 -32.56 22.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.928 0.394 . . . . 0.0 110.512 179.881 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 700' ' ' CYS . . . . . 0.574 ' HA ' HD23 ' A' ' 704' ' ' LEU . 1.7 m -65.21 -30.28 71.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.714 179.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -100.91 -1.9 33.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.615 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 702' ' ' TYR . . . . . 0.456 ' CE2' HG21 ' A' ' 638' ' ' ILE . 4.8 m-85 -116.33 -79.59 0.59 Allowed 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 120.813 0.34 . . . . 0.0 111.524 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 1.6 tp -61.52 -40.51 94.89 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.722 -179.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.574 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.4 OUTLIER -48.31 -56.94 6.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.886 0.374 . . . . 0.0 111.429 -179.566 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 12.9 p -54.63 -47.33 73.61 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.383 -179.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 706' ' ' TYR . . . . . 0.63 ' O ' HD22 ' A' ' 709' ' ' LEU . 10.2 t80 -66.13 -29.44 69.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.591 -179.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -96.71 -0.09 48.8 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 6.9 t -116.92 -15.77 10.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.541 0.21 . . . . 0.0 111.523 -179.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 709' ' ' LEU . . . . . 0.63 HD22 ' O ' ' A' ' 706' ' ' TYR . 0.2 OUTLIER -73.96 175.14 7.65 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.751 0.31 . . . . 0.0 110.934 -179.949 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.41 164.51 59.14 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.958 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -66.5 -30.88 43.01 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.604 2.203 . . . . 0.0 111.961 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -48.94 -50.2 36.6 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.831 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 713' ' ' GLU . . . . . 0.449 ' HB2' ' CD1' ' A' ' 709' ' ' LEU . 3.5 mm-40 -58.26 -29.35 65.73 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.891 179.759 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 714' ' ' HIS . . . . . 0.485 ' CD2' ' CE1' ' A' ' 706' ' ' TYR . 1.8 m170 -75.76 -53.96 7.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.497 179.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 1.9 mtp-105 -60.22 -47.79 84.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.38 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.06 -54.05 40.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.553 -179.369 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . 0.64 HD13 ' HB2' ' A' ' 632' ' ' HIS . 84.8 mt -62.89 -42.38 99.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.128 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . 0.633 ' HG3' HD23 ' A' ' 722' ' ' LEU . 28.4 tt0 -67.37 -54.22 22.5 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.502 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -51.04 -33.66 26.42 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.323 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 720' ' ' GLU . . . . . 0.412 ' O ' ' HG2' ' A' ' 723' ' ' MET . 0.2 OUTLIER -69.42 -55.68 9.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.974 0.416 . . . . 0.0 110.563 179.8 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 721' ' ' VAL . . . . . 0.535 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 23.3 t -63.44 -54.94 26.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.143 -179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . 0.724 HD13 ' HE2' ' A' ' 725' ' ' LYS . 3.6 mm? -50.36 -43.29 54.19 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.779 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 723' ' ' MET . . . . . 0.62 ' HB2' HD13 ' A' ' 727' ' ' ILE . 13.4 ptp -72.12 -40.53 68.04 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.688 -0.405 . . . . 0.0 110.079 179.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 724' ' ' GLU . . . . . 0.429 ' N ' ' HG3' ' A' ' 723' ' ' MET . 2.2 mt-10 -52.41 -37.7 57.3 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.272 -179.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 725' ' ' LYS . . . . . 0.724 ' HE2' HD13 ' A' ' 722' ' ' LEU . 0.0 OUTLIER -86.05 -45.71 11.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.227 -179.786 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -59.67 -55.75 30.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.199 -179.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 727' ' ' ILE . . . . . 0.642 HG22 ' O ' ' A' ' 727' ' ' ILE . 4.2 mp -88.73 11.76 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.591 -179.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 7.3 tt -48.93 -31.73 7.82 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.757 0.313 . . . . 0.0 111.213 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -61.09 -46.21 91.57 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.858 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 730' ' ' LYS . . . . . 0.463 ' HB2' HG22 ' A' ' 727' ' ' ILE . 1.6 mtpt . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.208 -0.901 . . . . 0.0 110.807 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.193 0 CA-C-O 120.143 -0.254 . . . . 0.0 112.487 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_exo -51.59 -44.65 42.76 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.425 2.084 . . . . 0.0 112.293 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.2 mp -79.67 165.16 23.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.873 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . -135.26 -141.53 4.4 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.498 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -96.8 79.1 2.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.861 0.363 . . . . 0.0 110.914 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 11.4 mt -128.3 175.73 8.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.863 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 117.91 -53.59 0.64 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.539 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 19.8 mmm180 -129.67 -145.97 0.3 Allowed 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 110.371 -0.233 . . . . 0.0 110.371 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 5.1 mtp85 -61.95 121.49 13.09 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.781 0.324 . . . . 0.0 110.9 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 619' ' ' TRP . . . . . 0.629 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.1 OUTLIER -63.17 -16.82 61.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.347 -179.993 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 117.84 160.16 11.55 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.45 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -67.08 -33.73 30.81 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.57 2.18 . . . . 0.0 112.081 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 622' ' ' ASN . . . . . 0.441 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 19.5 m-80 -68.13 -34.8 77.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.813 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 623' ' ' VAL . . . . . 0.446 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 56.1 t -71.11 -45.32 72.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.582 179.576 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 624' ' ' GLN . . . . . 0.491 ' HG2' HD11 ' A' ' 722' ' ' LEU . 34.9 tp60 -59.47 -37.84 79.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.42 179.573 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.84 -50.75 69.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.256 179.431 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 9.3 tt -67.78 -28.69 67.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.712 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -72.03 -51.32 22.33 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.09 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.13 -47.85 80.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.935 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 629' ' ' ILE . . . . . 0.494 HG22 ' CD1' ' A' ' 633' ' ' LEU . 38.8 mt -63.63 -37.58 80.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.828 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 2.6 ttpp -63.88 -47.52 80.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.79 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 5.3 tttm -60.28 -40.1 89.21 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.875 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 632' ' ' HIS . . . . . 0.852 ' CE1' HD11 ' A' ' 709' ' ' LEU . 73.7 t60 -70.87 -42.82 69.57 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.986 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.598 HD13 ' SD ' ' A' ' 640' ' ' MET . 20.1 mt -57.63 -50.06 74.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.222 -179.692 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 3.3 ptt85 -62.96 -44.12 96.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.817 0.341 . . . . 0.0 110.822 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.69 -11.56 60.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.221 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 636' ' ' GLN . . . . . 0.454 ' CG ' ' CE1' ' A' ' 632' ' ' HIS . 23.4 mm-40 -97.2 -7.84 31.43 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.572 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 111.89 6.75 24.32 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.375 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 638' ' ' ILE . . . . . . . . . . . . . 18.0 mt -117.03 107.86 23.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.419 0 CA-C-O 120.679 0.276 . . . . 0.0 111.318 -179.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -82.55 113.61 20.39 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.865 0.364 . . . . 0.0 110.791 179.743 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 640' ' ' MET . . . . . 0.598 ' SD ' HD13 ' A' ' 633' ' ' LEU . 2.0 ttp -124.15 35.45 4.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.883 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -69.53 -31.82 70.27 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.038 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 642' ' ' GLU . . . . . 0.415 ' O ' HD12 ' A' ' 643' ' ' LEU . 4.6 mm-40 -70.84 -79.01 0.07 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.971 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 643' ' ' LEU . . . . . 0.415 HD12 ' O ' ' A' ' 642' ' ' GLU . 0.1 OUTLIER -178.97 135.02 0.29 Allowed Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.845 179.964 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 644' ' ' PRO . . . . . 0.494 ' HB2' HD11 ' A' ' 651' ' ' LEU . 72.0 Cg_endo -74.69 138.61 24.07 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.523 2.149 . . . . 0.0 112.29 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 645' ' ' LEU . . . . . 0.655 HD12 ' HA ' ' A' ' 650' ' ' GLU . 5.0 tp -131.31 149.96 52.34 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.171 0.51 . . . . 0.0 111.134 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 646' ' ' ILE . . . . . 0.742 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.2 tt -146.84 131.8 11.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.418 -0.81 . . . . 0.0 109.568 178.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 52.36 44.2 58.23 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 120.283 -0.961 . . . . 0.0 112.226 -179.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 66.27 8.7 45.65 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 120.925 -0.655 . . . . 0.0 113.773 179.463 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 33.3 m -131.15 161.95 30.99 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 117.374 0.587 . . . . 0.0 111.377 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 650' ' ' GLU . . . . . 0.655 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.6 OUTLIER -80.09 143.53 33.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.768 179.897 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 651' ' ' LEU . . . . . 0.612 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -135.35 145.24 47.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.29 -179.692 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -97.33 110.79 23.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.886 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -52.14 -43.58 64.12 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.128 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 654' ' ' ALA . . . . . 0.441 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -60.89 -43.31 98.63 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.153 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 1.6 t -66.5 -35.5 80.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.803 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 656' ' ' PHE . . . . . 0.499 ' HD2' HD23 ' A' ' 651' ' ' LEU . 0.1 OUTLIER -72.78 -43.61 62.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.938 -179.98 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -59.7 -46.62 88.53 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.854 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 37.8 mtp180 -63.57 -43.87 95.77 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.048 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . 0.794 HD13 ' CD2' ' A' ' 682' ' ' LEU . 0.2 OUTLIER -59.36 -49.55 77.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.359 -179.67 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 660' ' ' ILE . . . . . 0.569 HD11 ' HH2' ' A' ' 675' ' ' TRP . 41.4 mt -56.83 -45.97 83.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-O 120.721 0.296 . . . . 0.0 110.889 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 37.5 t-20 -66.88 -46.24 75.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.163 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -56.32 -21.38 23.89 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.548 -179.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.86 28.64 1.76 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.627 -0.26 . . . . 0.0 111.31 -179.765 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 90.49 -16.85 56.82 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.78 179.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 135.79 179.43 16.6 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.32 -179.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 666' ' ' MET . . . . . 0.535 ' O ' HG22 ' A' ' 670' ' ' THR . 0.0 OUTLIER -72.64 -40.63 66.24 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.741 0.305 . . . . 0.0 111.199 -179.954 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 667' ' ' GLN . . . . . 0.404 ' HG2' ' N ' ' A' ' 668' ' ' GLN . 6.6 pm0 -51.13 -43.64 61.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.457 -179.548 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 668' ' ' GLN . . . . . 0.404 ' N ' ' HG2' ' A' ' 667' ' ' GLN . 0.0 OUTLIER -64.8 -52.44 56.82 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.879 0.371 . . . . 0.0 110.925 -179.926 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 669' ' ' VAL . . . . . 0.483 ' HB ' ' HE1' ' A' ' 666' ' ' MET . 89.5 t -49.33 -54.15 6.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.524 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 670' ' ' THR . . . . . 0.535 HG22 ' O ' ' A' ' 666' ' ' MET . 9.6 t -76.18 -54.3 7.01 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 113.464 0.913 . . . . 0.0 113.464 -178.563 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 671' ' ' ASP . . . . . 0.503 ' N ' HG23 ' A' ' 670' ' ' THR . 69.7 m-20 -56.88 -51.18 70.09 Favored 'General case' 0 N--CA 1.464 0.272 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -177.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 672' ' ' LEU . . . . . 0.404 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 7.9 mp -77.88 1.62 19.9 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -179.068 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 48.98 83.48 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 120.951 0.405 . . . . 0.0 110.439 -179.845 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 4.9 mtpm? -144.79 21.51 1.63 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.288 -179.584 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 675' ' ' TRP . . . . . 1.117 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 35.1 m95 -58.34 -29.16 65.72 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-O 121.338 0.589 . . . . 0.0 110.049 179.654 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 676' ' ' ASN . . . . . 0.414 ' CG ' HD11 ' A' ' 692' ' ' LEU . 13.0 m120 -56.8 -41.27 77.46 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.676 -179.622 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 9.1 mttt -78.54 -51.95 9.2 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 120.774 0.321 . . . . 0.0 111.565 -179.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 1.012 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -56.77 -40.72 76.33 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 179.404 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 679' ' ' ALA . . . . . 0.796 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.94 -31.84 66.73 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.301 178.746 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -53.28 -48.18 68.53 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.038 179.379 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -62.04 -23.8 66.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.794 179.397 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 682' ' ' LEU . . . . . 0.794 ' CD2' HD13 ' A' ' 659' ' ' LEU . 3.0 mm? -79.59 -2.42 42.42 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.507 179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . 0.775 ' C ' HD12 ' A' ' 684' ' ' ILE . 6.3 mmm180 70.49 72.01 0.21 Allowed 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 120.933 0.397 . . . . 0.0 111.443 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . 0.775 HD12 ' C ' ' A' ' 683' ' ' ARG . 2.4 mp -128.52 141.78 42.63 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.456 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . 0.664 ' HD2' HG23 ' A' ' 684' ' ' ILE . 38.1 Cg_endo -68.16 121.33 8.31 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.261 1.974 . . . . 0.0 112.05 179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -70.54 -25.08 62.94 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.432 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.37 -18.52 65.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.595 -179.515 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 688' ' ' ALA . . . . . 0.483 ' HB3' ' HB2' ' A' ' 691' ' ' ARG . . . -77.1 111.91 13.2 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.774 0.321 . . . . 0.0 111.425 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -83.17 -7.6 59.6 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.455 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -97.67 -27.58 14.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.148 0.499 . . . . 0.0 109.926 179.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 691' ' ' ARG . . . . . 0.483 ' HB2' ' HB3' ' A' ' 688' ' ' ALA . 0.3 OUTLIER -52.39 -46.72 66.38 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.32 -179.641 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . 0.451 HD13 ' HA ' ' A' ' 692' ' ' LEU . 3.8 mm? -59.74 -46.2 89.87 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.299 -179.658 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.42 -39.49 67.87 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.823 0.344 . . . . 0.0 111.411 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.39 -41.93 93.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.453 179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 1.117 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 1.1 tp -64.7 -44.67 89.51 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.544 179.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.453 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 2.2 mm-40 -55.55 -47.75 75.85 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.879 179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -76.41 -29.45 57.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.211 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . 0.402 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.56 -37.1 82.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.721 -179.648 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 699' ' ' TYR . . . . . 0.493 ' CZ ' ' HE3' ' A' ' 666' ' ' MET . 1.3 p90 -85.38 -36.83 20.47 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.932 0.396 . . . . 0.0 110.394 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 700' ' ' CYS . . . . . . . . . . . . . 5.3 m -62.77 -30.47 71.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.546 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -95.89 -4.93 42.65 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.392 179.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 702' ' ' TYR . . . . . 0.459 ' CD2' HD21 ' A' ' 633' ' ' LEU . 6.8 m-85 -121.56 -75.47 0.59 Allowed 'General case' 0 C--N 1.333 -0.13 0 CA-C-O 120.838 0.352 . . . . 0.0 111.257 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -54.01 -48.91 69.97 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.476 -179.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.424 HD23 ' CE1' ' A' ' 699' ' ' TYR . 1.3 mm? -54.9 -29.57 56.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.099 -179.886 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 24.5 m -69.74 -55.4 10.01 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.424 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 706' ' ' TYR . . . . . 0.414 ' HA ' HD12 ' A' ' 709' ' ' LEU . 68.8 t80 -62.8 -29.57 70.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.931 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -85.5 -17.48 36.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.317 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 4.4 m -90.73 -21.91 21.35 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.84 0.352 . . . . 0.0 111.05 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 709' ' ' LEU . . . . . 0.852 HD11 ' CE1' ' A' ' 632' ' ' HIS . 60.6 mt -56.53 146.4 25.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.371 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 710' ' ' SER . . . . . 0.439 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.4 OUTLIER -79.39 167.67 32.56 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.607 179.732 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . 0.439 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 9.9 Cg_endo -53.15 -23.06 21.3 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.631 2.221 . . . . 0.0 112.401 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -70.18 -55.21 9.92 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.852 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 713' ' ' GLU . . . . . 0.562 ' O ' HD12 ' A' ' 717' ' ' LEU . 1.6 mm-40 -63.2 -25.95 68.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.448 . . . . 0.0 110.845 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 9.9 m-70 -75.68 -54.69 6.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.116 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -64.9 -38.04 89.64 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.14 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 33.3 ttt180 -68.19 -54.11 20.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.104 -179.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . 0.596 ' O ' HG23 ' A' ' 721' ' ' VAL . 35.0 mt -64.58 -37.61 88.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.802 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . 0.401 ' O ' ' HB2' ' A' ' 722' ' ' LEU . 31.9 tt0 -71.24 -54.24 11.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.557 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 1.5 mmtt -52.4 -32.46 39.05 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.771 0.319 . . . . 0.0 111.191 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 720' ' ' GLU . . . . . 0.44 ' O ' ' HG2' ' A' ' 723' ' ' MET . 0.5 OUTLIER -70.02 -55.73 8.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.032 0.444 . . . . 0.0 110.468 179.652 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 721' ' ' VAL . . . . . 0.629 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 21.7 t -63.43 -53.49 44.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.183 -179.723 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . 0.491 HD11 ' HG2' ' A' ' 624' ' ' GLN . 1.2 mp -53.12 -41.0 64.61 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.998 -179.352 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 723' ' ' MET . . . . . 0.575 ' O ' HD12 ' A' ' 727' ' ' ILE . 14.0 ptp -72.0 -38.75 69.6 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.624 -0.43 . . . . 0.0 110.101 179.745 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 40.7 mm-40 -57.33 -33.64 67.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.117 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 725' ' ' LYS . . . . . 0.457 ' HD2' ' CE2' ' A' ' 619' ' ' TRP . 0.0 OUTLIER -86.14 -38.83 17.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.367 -179.704 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -68.41 -50.18 54.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.841 0.353 . . . . 0.0 111.13 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 727' ' ' ILE . . . . . 0.653 HG22 ' O ' ' A' ' 727' ' ' ILE . 4.3 mp -88.2 11.47 1.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.551 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 3.4 tt -59.49 -35.43 74.11 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.867 0.365 . . . . 0.0 110.906 179.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -79.86 -71.07 0.47 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.991 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 730' ' ' LYS . . . . . 0.546 ' HG3' HG23 ' A' ' 727' ' ' ILE . 13.1 ptmt . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.235 -0.888 . . . . 0.0 110.917 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.206 0 N-CA-C 112.411 -0.276 . . . . 0.0 112.411 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -51.99 -28.56 32.5 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.535 2.157 . . . . 0.0 112.342 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . 0.542 HD23 HD12 ' A' ' 615' ' ' LEU . 4.6 mp -62.94 169.51 3.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.927 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . -112.08 -120.35 3.85 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.49 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -98.79 31.42 2.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.815 0.34 . . . . 0.0 110.895 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 615' ' ' LEU . . . . . 0.542 HD12 HD23 ' A' ' 612' ' ' LEU . 60.1 mt -68.47 -176.75 0.81 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.831 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 151.23 -52.38 0.5 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.52 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 5.0 mmm180 -109.94 -143.66 0.39 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.46 0.171 . . . . 0.0 110.593 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 60.8 mtt180 -56.27 137.79 51.62 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.864 0.364 . . . . 0.0 111.205 -179.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 619' ' ' TRP . . . . . 0.614 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.1 OUTLIER -72.78 -10.42 59.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.349 179.915 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 116.6 160.52 12.07 Favored Glycine 0 C--N 1.331 0.286 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.433 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -68.21 -39.03 10.97 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.541 2.161 . . . . 0.0 112.222 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 10.8 p30 -66.24 -34.22 77.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.885 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 623' ' ' VAL . . . . . 0.445 HG11 ' HB2' ' A' ' 619' ' ' TRP . 44.1 t -68.19 -45.65 82.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.712 179.669 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 624' ' ' GLN . . . . . 0.513 ' HG2' HD11 ' A' ' 722' ' ' LEU . 41.2 tp60 -60.95 -39.61 90.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.543 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 625' ' ' ARG . . . . . 0.484 ' O ' HD12 ' A' ' 629' ' ' ILE . 0.0 OUTLIER -59.52 -50.82 72.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.57 179.702 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 6.7 tt -68.51 -29.71 68.36 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.871 179.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -70.24 -50.27 41.54 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.373 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -65.5 -37.1 85.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.346 -179.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 629' ' ' ILE . . . . . 0.523 HD13 ' HB3' ' A' ' 653' ' ' LEU . 38.7 mt -63.86 -54.01 37.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.327 -179.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 630' ' ' LYS . . . . . 0.559 ' HB3' ' HE1' ' A' ' 640' ' ' MET . 0.9 OUTLIER -61.69 -32.41 72.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.269 -179.71 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 631' ' ' LYS . . . . . 0.425 ' N ' ' HG3' ' A' ' 630' ' ' LYS . 1.8 tttm -63.1 -50.96 68.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.84 0.352 . . . . 0.0 111.329 -179.704 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 632' ' ' HIS . . . . . 0.596 ' HB3' HD13 ' A' ' 717' ' ' LEU . 3.5 p-80 -68.31 -39.7 81.93 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.712 179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.463 ' N ' ' CD2' ' A' ' 632' ' ' HIS . 41.8 mt -56.82 -49.84 74.2 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.144 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 634' ' ' ARG . . . . . 0.468 ' HG3' ' N ' ' A' ' 635' ' ' SER . 11.8 ptt180 -64.08 -39.34 93.85 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.781 0.324 . . . . 0.0 110.615 179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 635' ' ' SER . . . . . 0.468 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 75.1 m -73.61 -17.24 61.19 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.011 179.635 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 636' ' ' GLN . . . . . 0.679 ' OE1' HD11 ' A' ' 709' ' ' LEU . 0.0 OUTLIER -93.0 -7.17 46.59 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.466 -179.823 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 111.86 3.69 26.53 Favored Glycine 0 C--N 1.331 0.305 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.601 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 638' ' ' ILE . . . . . 0.452 HG21 ' CZ ' ' A' ' 702' ' ' TYR . 17.3 mt -109.66 104.85 17.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 CA-C-O 120.694 0.283 . . . . 0.0 111.284 -179.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -78.05 129.82 35.7 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.952 0.406 . . . . 0.0 111.061 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 640' ' ' MET . . . . . 0.559 ' HE1' ' HB3' ' A' ' 630' ' ' LYS . 0.2 OUTLIER -129.79 5.59 5.05 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.466 -179.948 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -58.56 -26.76 63.91 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.742 0.306 . . . . 0.0 111.248 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 642' ' ' GLU . . . . . 0.597 ' O ' HD12 ' A' ' 643' ' ' LEU . 28.9 mt-10 -66.43 -80.8 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.953 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 643' ' ' LEU . . . . . 0.597 HD12 ' O ' ' A' ' 642' ' ' GLU . 0.0 OUTLIER -177.11 118.52 0.26 Allowed Pre-proline 0 C--N 1.331 -0.224 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.901 -179.98 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -65.53 134.49 38.57 Favored 'Trans proline' 0 C--N 1.346 0.43 0 C-N-CA 122.425 2.083 . . . . 0.0 112.432 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 645' ' ' LEU . . . . . 0.645 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.6 tp -144.06 151.5 39.73 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.336 0.588 . . . . 0.0 111.441 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 646' ' ' ILE . . . . . 0.557 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.6 tt -149.65 133.49 8.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.228 -0.896 . . . . 0.0 109.705 178.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 52.65 40.73 56.08 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.302 -0.951 . . . . 0.0 112.218 -179.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.35 6.78 58.91 Favored Glycine 0 C--N 1.332 0.361 0 C-N-CA 120.986 -0.626 . . . . 0.0 113.839 179.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 6.3 m -132.08 163.04 29.34 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 117.413 0.606 . . . . 0.0 111.557 -179.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 650' ' ' GLU . . . . . 0.645 ' HA ' HD12 ' A' ' 645' ' ' LEU . 1.0 OUTLIER -78.94 144.27 34.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.727 179.77 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 651' ' ' LEU . . . . . 0.622 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.86 144.99 47.86 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.249 -179.751 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -96.58 110.75 23.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.875 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 653' ' ' LEU . . . . . 0.523 ' HB3' HD13 ' A' ' 629' ' ' ILE . 3.7 mm? -52.14 -32.68 36.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.163 -179.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -70.1 -44.41 69.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.166 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 14.4 t -69.1 -37.35 78.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.925 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 656' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -68.77 -45.9 70.16 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.884 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -58.36 -49.77 76.02 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.981 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 1.8 mtt85 -60.04 -42.48 94.53 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.817 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . 0.809 HD13 HD21 ' A' ' 682' ' ' LEU . 0.0 OUTLIER -57.67 -50.45 73.14 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.307 -179.729 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 660' ' ' ILE . . . . . 0.663 HD12 HD22 ' A' ' 703' ' ' LEU . 17.3 mt -56.71 -45.57 82.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.782 0.325 . . . . 0.0 110.841 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -63.47 -45.97 88.36 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.739 179.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -65.27 -19.97 66.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.2 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 8.9 mmm -90.2 36.67 0.88 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.543 -0.299 . . . . 0.0 111.477 -179.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 69.55 40.65 77.96 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.65 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 78.53 174.52 44.23 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.613 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 666' ' ' MET . . . . . 0.582 ' HG2' HG21 ' A' ' 660' ' ' ILE . 0.0 OUTLIER -73.01 -34.66 66.5 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.803 0.335 . . . . 0.0 111.287 -179.981 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -54.67 -45.7 73.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.434 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 668' ' ' GLN . . . . . 0.482 ' HA ' HD13 ' A' ' 672' ' ' LEU . 0.0 OUTLIER -62.58 -52.37 63.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.955 0.407 . . . . 0.0 110.774 179.943 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 669' ' ' VAL . . . . . 0.514 ' HB ' ' HE2' ' A' ' 666' ' ' MET . 75.1 t -49.21 -55.75 3.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.777 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 670' ' ' THR . . . . . 0.55 HG22 ' O ' ' A' ' 666' ' ' MET . 9.2 t -76.05 -51.65 11.84 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 113.63 0.974 . . . . 0.0 113.63 -178.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 671' ' ' ASP . . . . . 0.496 ' N ' HG23 ' A' ' 670' ' ' THR . 4.0 t70 -60.0 -51.2 70.67 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -177.758 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 672' ' ' LEU . . . . . 0.482 HD13 ' HA ' ' A' ' 668' ' ' GLN . 10.7 mp -77.16 1.19 19.03 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -178.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 11.6 mtpp 49.36 87.21 0.03 OUTLIER 'General case' 0 CA--C 1.521 -0.163 0 CA-C-O 121.133 0.492 . . . . 0.0 110.385 -179.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -150.08 22.07 0.86 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.632 -0.713 . . . . 0.0 111.199 -179.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 675' ' ' TRP . . . . . 1.14 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 36.5 m95 -57.83 -28.49 64.13 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 121.444 0.64 . . . . 0.0 109.988 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 676' ' ' ASN . . . . . 0.403 ' O ' ' HB2' ' A' ' 680' ' ' ASP . 5.0 m-80 -55.18 -42.65 73.5 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.608 -179.672 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.78 -51.64 10.19 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 120.677 0.275 . . . . 0.0 111.662 -179.337 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 1.018 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -56.46 -40.07 74.25 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.827 -0.435 . . . . 0.0 109.827 179.771 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 679' ' ' ALA . . . . . 0.837 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.56 -35.64 70.67 Favored 'General case' 0 C--N 1.334 -0.079 0 CA-C-O 120.763 0.316 . . . . 0.0 110.567 179.199 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 680' ' ' ASP . . . . . 0.403 ' HB2' ' O ' ' A' ' 676' ' ' ASN . 6.0 t0 -53.03 -47.08 68.64 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.382 179.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 1.8 mtm -65.4 -22.51 66.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.872 179.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 682' ' ' LEU . . . . . 0.809 HD21 HD13 ' A' ' 659' ' ' LEU . 3.5 mm? -78.97 -2.15 38.76 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.576 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . 0.732 ' C ' HD12 ' A' ' 684' ' ' ILE . 3.4 mtp180 71.44 72.03 0.17 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.945 0.402 . . . . 0.0 111.608 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . 0.732 HD12 ' C ' ' A' ' 683' ' ' ARG . 3.2 mp -131.25 140.1 37.49 Favored Pre-proline 0 CA--C 1.532 0.262 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.282 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . 0.61 ' HD2' HG23 ' A' ' 684' ' ' ILE . 32.8 Cg_endo -64.85 123.24 11.35 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.52 2.147 . . . . 0.0 112.756 -179.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.97 -23.29 63.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.954 179.637 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.35 -23.73 67.06 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.272 -179.726 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -72.57 111.63 7.91 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.808 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -70.87 -68.83 0.41 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.952 -179.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -53.74 -15.71 1.37 Allowed 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -179.443 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 691' ' ' ARG . . . . . 0.433 ' NH2' ' HB3' ' A' ' 679' ' ' ALA . 0.0 OUTLIER -51.91 -35.28 44.94 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.79 0.329 . . . . 0.0 110.867 179.83 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . 0.431 HD22 ' N ' ' A' ' 692' ' ' LEU . 3.5 mm? -70.37 -46.85 63.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.938 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.0 -37.85 69.76 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.236 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 2.9 mmtp -62.61 -39.91 95.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.087 0.47 . . . . 0.0 110.07 179.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 1.14 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.4 OUTLIER -66.8 -44.67 80.62 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.44 179.609 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.47 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 3.0 mt-30 -55.22 -46.17 75.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.757 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -77.23 -29.47 54.14 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.878 179.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . 0.418 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -68.94 -39.5 79.53 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.775 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 699' ' ' TYR . . . . . 0.498 ' CZ ' ' HE1' ' A' ' 666' ' ' MET . 0.7 OUTLIER -85.77 -31.33 22.43 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.937 0.398 . . . . 0.0 110.562 179.971 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 700' ' ' CYS . . . . . 0.57 ' HA ' HD23 ' A' ' 704' ' ' LEU . 8.6 m -68.14 -30.24 69.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.648 179.601 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.0 -1.25 43.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.411 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 702' ' ' TYR . . . . . 0.452 ' CZ ' HG21 ' A' ' 638' ' ' ILE . 6.1 m-85 -118.69 -78.67 0.59 Allowed 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.871 0.367 . . . . 0.0 111.35 -179.739 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 703' ' ' LEU . . . . . 0.663 HD22 HD12 ' A' ' 660' ' ' ILE . 0.4 OUTLIER -59.24 -42.02 90.11 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.712 -179.243 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.57 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.6 OUTLIER -55.21 -41.61 72.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.874 0.369 . . . . 0.0 111.136 -179.71 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.45 -55.87 28.27 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.408 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 706' ' ' TYR . . . . . 0.483 ' HA ' HD12 ' A' ' 709' ' ' LEU . 3.1 t80 -56.34 -47.75 78.18 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.984 179.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 74.9 m-20 -66.54 -18.57 65.44 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.133 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 24.9 p -91.36 -29.38 17.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.802 0.334 . . . . 0.0 110.904 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 709' ' ' LEU . . . . . 0.679 HD11 ' OE1' ' A' ' 636' ' ' GLN . 74.9 mt -61.32 157.56 16.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.902 179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -79.11 165.66 47.32 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.711 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -55.52 -22.36 34.58 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.482 2.121 . . . . 0.0 112.172 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -61.87 -54.31 43.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.903 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 713' ' ' GLU . . . . . 0.585 ' HG3' HD22 ' A' ' 709' ' ' LEU . 52.6 mm-40 -60.45 -26.38 66.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.109 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 16.4 m170 -75.98 -54.42 6.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.479 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 715' ' ' ARG . . . . . 0.457 ' HG3' ' N ' ' A' ' 716' ' ' ARG . 0.8 OUTLIER -62.56 -41.33 98.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.464 -179.451 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 716' ' ' ARG . . . . . 0.457 ' N ' ' HG3' ' A' ' 715' ' ' ARG . 0.2 OUTLIER -66.92 -54.0 26.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.844 0.354 . . . . 0.0 111.061 -179.654 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . 0.596 HD13 ' HB3' ' A' ' 632' ' ' HIS . 59.9 mt -63.13 -41.24 99.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.969 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -69.17 -54.3 15.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.552 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.26 -32.35 24.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.167 -179.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 720' ' ' GLU . . . . . 0.446 ' O ' ' HG2' ' A' ' 723' ' ' MET . 1.8 mt-10 -70.17 -55.55 9.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.047 0.451 . . . . 0.0 110.402 179.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 721' ' ' VAL . . . . . 0.614 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 20.0 t -62.59 -53.89 41.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.13 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . 0.513 HD11 ' HG2' ' A' ' 624' ' ' GLN . 1.1 mp -52.93 -41.3 64.34 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.046 -179.222 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 723' ' ' MET . . . . . 0.591 ' O ' HD12 ' A' ' 727' ' ' ILE . 15.2 ptp -72.97 -40.09 65.59 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.578 -0.449 . . . . 0.0 110.121 179.745 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -57.54 -31.31 65.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.321 -179.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 725' ' ' LYS . . . . . 0.439 ' HD3' ' CE2' ' A' ' 619' ' ' TRP . 3.4 pttp -86.14 -39.83 16.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.402 -179.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -69.86 -51.89 29.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.24 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 727' ' ' ILE . . . . . 0.627 HG22 ' O ' ' A' ' 727' ' ' ILE . 3.9 mp -87.7 11.63 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.733 -179.773 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 3.0 tt -56.27 -42.41 77.39 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.82 0.343 . . . . 0.0 111.007 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -75.22 -54.11 7.67 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.948 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 1.2 mtmm . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.899 179.98 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.232 0 N-CA-C 112.492 -0.243 . . . . 0.0 112.492 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -68.98 -29.68 27.21 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.621 2.214 . . . . 0.0 112.305 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 5.5 mt -66.06 170.55 5.5 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.909 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 99.61 147.66 21.87 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.512 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 60.99 77.35 0.33 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.862 0.363 . . . . 0.0 110.922 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 3.4 mt -85.44 -178.69 6.77 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.813 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 152.58 110.09 0.43 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.634 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . 0.46 ' O ' ' HG2' ' A' ' 617' ' ' ARG . 0.0 OUTLIER -122.25 118.38 28.41 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 121.524 0.678 . . . . 0.0 110.625 179.869 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 2.5 mpt_? -103.93 137.24 42.2 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.078 -0.964 . . . . 0.0 111.069 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 619' ' ' TRP . . . . . 0.468 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.0 OUTLIER -74.89 -12.58 60.4 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.345 179.981 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 122.15 159.95 10.79 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.498 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -68.42 -32.68 25.01 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 122.555 2.17 . . . . 0.0 112.025 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 622' ' ' ASN . . . . . 0.506 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 6.8 p30 -70.74 -33.51 70.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.702 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 623' ' ' VAL . . . . . 0.468 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 57.0 t -76.04 -41.65 38.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.34 179.153 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 624' ' ' GLN . . . . . 0.699 ' CG ' HD11 ' A' ' 722' ' ' LEU . 7.8 tm0? -59.36 -40.45 86.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.253 179.514 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.53 -50.93 63.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.301 179.399 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 626' ' ' LEU . . . . . 0.709 ' O ' HD13 ' A' ' 626' ' ' LEU . 2.8 tm? -57.83 -39.49 77.77 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.653 179.506 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . 0.455 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -69.09 -52.59 26.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.282 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -56.92 -50.54 72.24 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.235 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 629' ' ' ILE . . . . . 0.599 HG22 HD11 ' A' ' 633' ' ' LEU . 25.6 mt -59.29 -39.53 79.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.153 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 7.0 ttpt -63.8 -49.64 72.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.919 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.32 -40.86 78.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.223 -179.908 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 632' ' ' HIS . . . . . 0.907 ' CE1' HD11 ' A' ' 709' ' ' LEU . 85.6 t60 -71.67 -40.9 69.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.039 -179.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.745 HD13 ' SD ' ' A' ' 640' ' ' MET . 10.2 mt -56.83 -49.9 74.02 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.147 -179.74 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 1.5 ptt180 -65.71 -40.52 92.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.754 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 66.1 m -73.33 -13.74 61.16 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.25 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 636' ' ' GLN . . . . . 0.401 ' NE2' ' CE1' ' A' ' 632' ' ' HIS . 0.1 OUTLIER -98.06 -4.74 35.32 Favored 'General case' 0 C--N 1.332 -0.187 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 -179.754 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 109.24 5.84 30.01 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.558 -0.83 . . . . 0.0 112.536 179.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 638' ' ' ILE . . . . . . . . . . . . . 18.1 mt -113.77 108.96 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 CA-C-O 120.648 0.261 . . . . 0.0 111.277 -179.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -83.67 107.73 16.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.851 0.358 . . . . 0.0 110.913 179.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 640' ' ' MET . . . . . 0.745 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.6 ttp -117.09 35.14 4.77 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.817 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -74.61 -37.75 62.76 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.157 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -62.02 -82.0 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.052 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 1.7 pp -177.8 117.43 0.25 Allowed Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 116.486 -0.324 . . . . 0.0 110.949 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_exo -59.33 150.94 71.55 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.406 2.071 . . . . 0.0 112.241 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 645' ' ' LEU . . . . . 0.692 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.7 tp -144.39 151.4 39.22 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.191 0.52 . . . . 0.0 111.405 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 646' ' ' ILE . . . . . 0.755 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.6 tt -149.81 133.87 8.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.688 178.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 52.57 40.12 54.6 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.34 -0.933 . . . . 0.0 112.282 -179.298 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.58 7.42 61.07 Favored Glycine 0 C--N 1.333 0.404 0 C-N-CA 120.964 -0.636 . . . . 0.0 113.658 179.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.7 m -131.99 162.35 30.92 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 117.346 0.573 . . . . 0.0 111.481 -179.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 650' ' ' GLU . . . . . 0.692 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.9 OUTLIER -77.77 143.84 37.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.825 179.809 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 651' ' ' LEU . . . . . 0.613 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -135.42 145.4 47.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.066 0.46 . . . . 0.0 111.426 -179.588 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -99.18 112.36 24.53 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.754 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 653' ' ' LEU . . . . . 0.403 ' HA ' HD13 ' A' ' 653' ' ' LEU . 3.7 mm? -52.64 -39.06 61.4 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.008 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 654' ' ' ALA . . . . . 0.506 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -64.14 -43.73 94.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.003 179.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 4.2 t -67.57 -39.67 84.91 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.043 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 656' ' ' PHE . . . . . 0.439 ' CE2' ' HG ' ' A' ' 682' ' ' LEU . 0.7 OUTLIER -67.44 -42.74 82.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.708 -179.983 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -59.7 -45.9 90.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.805 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 3.8 mtm180 -63.04 -43.21 99.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.538 179.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . 0.434 HD11 ' CE ' ' A' ' 681' ' ' MET . 0.6 OUTLIER -57.16 -51.45 69.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.938 -0.573 . . . . 0.0 110.966 179.972 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 660' ' ' ILE . . . . . 0.767 HG23 HG21 ' A' ' 669' ' ' VAL . 67.7 mt -57.68 -45.55 86.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.858 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -59.79 -39.69 85.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.82 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -61.15 -21.73 64.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.151 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . 0.429 ' CE ' ' HB3' ' A' ' 678' ' ' LEU . 0.0 OUTLIER -88.47 14.38 9.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.627 -179.769 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 86.11 17.63 60.73 Favored Glycine 0 C--N 1.332 0.358 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.926 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 111.49 169.87 18.79 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.592 -0.813 . . . . 0.0 112.71 179.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 666' ' ' MET . . . . . 0.725 ' HG2' HG21 ' A' ' 660' ' ' ILE . 0.0 OUTLIER -63.83 -31.93 73.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.768 0.318 . . . . 0.0 111.046 -179.972 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -55.6 -48.19 75.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.443 -179.573 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 668' ' ' GLN . . . . . 0.401 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 8.0 mm-40 -62.24 -52.59 63.13 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.842 0.354 . . . . 0.0 111.136 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 669' ' ' VAL . . . . . 0.767 HG21 HG23 ' A' ' 660' ' ' ILE . 60.7 t -50.92 -55.89 5.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.944 -179.649 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 670' ' ' THR . . . . . 0.523 HG23 ' N ' ' A' ' 671' ' ' ASP . 10.8 t -76.17 -53.07 8.82 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 -178.297 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 671' ' ' ASP . . . . . 0.523 ' N ' HG23 ' A' ' 670' ' ' THR . 4.4 t70 -57.32 -51.07 70.86 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -177.722 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 672' ' ' LEU . . . . . 0.401 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 9.1 mp -78.7 2.3 20.07 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -178.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 3.8 mmtp 48.27 86.09 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.076 0.465 . . . . 0.0 110.517 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -149.15 21.68 0.96 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.147 -179.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 675' ' ' TRP . . . . . 1.115 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 31.4 m95 -57.71 -28.4 63.82 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 121.327 0.584 . . . . 0.0 110.145 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -56.07 -42.05 76.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.853 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -77.49 -51.74 10.23 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 120.765 0.316 . . . . 0.0 111.665 -179.261 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 1.036 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -57.27 -40.55 77.96 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.677 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 679' ' ' ALA . . . . . 0.8 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.76 -33.63 68.81 Favored 'General case' 0 C--N 1.334 -0.082 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.412 178.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -53.16 -49.73 66.03 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.319 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 681' ' ' MET . . . . . 0.434 ' CE ' HD11 ' A' ' 659' ' ' LEU . 4.5 mtm -64.06 -22.37 66.9 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.867 179.366 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 682' ' ' LEU . . . . . 0.44 ' HB3' HD11 ' A' ' 684' ' ' ILE . 2.5 mm? -78.41 -3.34 42.77 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.526 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . 0.71 ' C ' HD12 ' A' ' 684' ' ' ILE . 23.9 mmt85 70.56 71.92 0.2 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.898 0.38 . . . . 0.0 111.546 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . 0.71 HD12 ' C ' ' A' ' 683' ' ' ARG . 2.1 mp -123.0 142.43 38.14 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.158 179.436 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . 0.698 ' HD2' HG23 ' A' ' 684' ' ' ILE . 53.5 Cg_endo -69.86 119.12 6.12 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.499 2.133 . . . . 0.0 112.634 -179.674 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.96 -23.04 63.12 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.045 179.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.23 -22.5 66.88 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.463 -179.635 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 688' ' ' ALA . . . . . 0.759 ' HB3' ' HG2' ' A' ' 691' ' ' ARG . . . -71.84 117.23 13.18 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.928 0.394 . . . . 0.0 111.075 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.25 3.82 29.61 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.37 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -121.69 -13.89 8.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.155 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 691' ' ' ARG . . . . . 0.826 ' HG3' HD22 ' A' ' 692' ' ' LEU . 0.2 OUTLIER -55.0 -35.1 64.0 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.811 0.338 . . . . 0.0 110.933 -179.673 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . 0.826 HD22 ' HG3' ' A' ' 691' ' ' ARG . 3.0 mm? -70.6 -47.69 58.87 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.042 179.641 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.93 -39.58 69.36 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.415 -179.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 3.8 mmtt -64.24 -40.78 96.74 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.241 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 1.115 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 3.9 tp -63.89 -47.04 82.23 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.844 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.431 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 0.0 OUTLIER -55.27 -49.09 72.96 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.189 -179.743 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -75.19 -29.49 60.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.126 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . . . . . . . . . . . -68.54 -38.09 80.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.749 -179.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 699' ' ' TYR . . . . . 0.458 ' CD2' ' CZ2' ' A' ' 675' ' ' TRP . 1.0 OUTLIER -86.47 -30.52 21.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.831 0.348 . . . . 0.0 110.736 -179.877 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 700' ' ' CYS . . . . . . . . . . . . . 15.3 t -69.45 -30.51 68.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.644 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -97.46 -1.37 44.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.472 -179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 702' ' ' TYR . . . . . 0.593 ' CD2' HD21 ' A' ' 633' ' ' LEU . 7.1 m-85 -121.51 -78.64 0.6 Allowed 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.831 0.348 . . . . 0.0 111.316 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 703' ' ' LEU . . . . . 0.622 ' CD2' HD12 ' A' ' 660' ' ' ILE . 1.1 mp -57.63 -44.55 85.66 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.523 -179.444 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.431 HD23 ' CE1' ' A' ' 699' ' ' TYR . 1.1 mm? -56.4 -49.41 74.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.86 0.362 . . . . 0.0 110.959 -179.801 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . 0.402 ' O ' ' HG ' ' A' ' 709' ' ' LEU . 22.7 m -54.7 -55.29 31.31 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.719 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 706' ' ' TYR . . . . . 0.599 ' HA ' HD12 ' A' ' 709' ' ' LEU . 56.4 t80 -63.77 -29.35 70.57 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.202 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -79.0 -20.96 47.76 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.247 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 1.7 m -91.54 -17.59 25.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.283 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 709' ' ' LEU . . . . . 0.907 HD11 ' CE1' ' A' ' 632' ' ' HIS . 78.2 mt -58.62 153.12 17.01 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.914 0.387 . . . . 0.0 111.113 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 710' ' ' SER . . . . . 0.451 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.6 OUTLIER -79.06 168.46 26.78 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.473 179.619 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . 0.451 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 14.4 Cg_endo -56.8 -19.78 32.72 Favored 'Trans proline' 0 C--N 1.345 0.344 0 C-N-CA 122.518 2.145 . . . . 0.0 112.524 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -67.49 -55.55 13.13 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.038 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 713' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -59.34 -26.17 64.82 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.075 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -75.83 -54.1 7.44 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.256 179.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 7.0 mtm180 -63.44 -40.82 98.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.428 -179.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.54 -54.08 27.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.755 0.312 . . . . 0.0 111.241 -179.598 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . 0.635 HD13 ' HB2' ' A' ' 632' ' ' HIS . 57.8 mt -64.85 -39.39 93.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.975 -179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . 0.65 ' HG2' HD22 ' A' ' 722' ' ' LEU . 13.7 tt0 -69.29 -54.2 15.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.561 179.828 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 9.4 mmtt -52.89 -33.33 49.75 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.378 -179.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 720' ' ' GLU . . . . . 0.433 ' O ' ' HG2' ' A' ' 723' ' ' MET . 12.3 mt-10 -69.56 -55.76 9.23 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.079 0.466 . . . . 0.0 110.623 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 721' ' ' VAL . . . . . 0.455 HG11 ' HB1' ' A' ' 627' ' ' ALA . 45.8 t -63.76 -53.33 45.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.15 -179.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . 0.699 HD11 ' CG ' ' A' ' 624' ' ' GLN . 8.0 mp -54.4 -38.77 66.59 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.865 -179.173 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 723' ' ' MET . . . . . 0.499 ' HB2' HD13 ' A' ' 727' ' ' ILE . 13.6 ptp -75.38 -40.61 57.82 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 120.54 -0.464 . . . . 0.0 110.033 179.605 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -54.32 -40.02 67.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.178 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 725' ' ' LYS . . . . . 0.454 ' HE2' ' CD2' ' A' ' 619' ' ' TRP . 0.0 OUTLIER -85.45 -42.64 14.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.097 -179.86 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -59.51 -53.46 57.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.949 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 727' ' ' ILE . . . . . 0.643 HG22 ' O ' ' A' ' 727' ' ' ILE . 4.2 mp -89.37 11.7 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.551 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 728' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 725' ' ' LYS . 1.7 tt -57.34 -45.56 84.2 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.853 0.359 . . . . 0.0 111.049 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -73.86 -54.71 7.37 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.979 -179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 6.9 mtmm . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.981 179.998 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.238 0 N-CA-C 112.504 -0.238 . . . . 0.0 112.504 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -68.01 -36.45 17.5 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.541 2.16 . . . . 0.0 112.346 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 3.3 mp -69.2 158.07 35.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.867 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . -76.32 76.97 1.42 Allowed Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.489 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -143.01 97.39 3.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.858 0.361 . . . . 0.0 110.866 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 11.8 mt -95.85 -176.27 3.67 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.924 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -114.22 58.54 0.43 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.536 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 34.7 mmt-85 -139.42 120.17 14.3 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 121.139 0.495 . . . . 0.0 110.657 179.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -176.18 134.77 0.26 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.575 -0.738 . . . . 0.0 110.83 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 619' ' ' TRP . . . . . 0.442 ' CD1' ' HB ' ' A' ' 623' ' ' VAL . 0.0 OUTLIER -62.29 -17.11 57.72 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.284 -179.97 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 126.11 163.21 11.49 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.491 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -68.52 -37.59 12.66 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 122.582 2.188 . . . . 0.0 112.241 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -67.35 -38.86 85.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.915 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 623' ' ' VAL . . . . . 0.442 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 40.1 t -70.98 -41.92 76.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.967 179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 624' ' ' GLN . . . . . 0.499 ' CG ' HD21 ' A' ' 722' ' ' LEU . 4.0 tm0? -58.6 -45.53 88.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.712 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 74.5 mtt-85 -62.18 -50.63 71.07 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.708 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 626' ' ' LEU . . . . . 0.599 ' O ' HD23 ' A' ' 626' ' ' LEU . 8.6 tt -61.51 -34.09 74.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.819 179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . 0.661 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -63.98 -53.76 45.09 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.185 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -58.97 -42.56 90.25 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.997 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 629' ' ' ILE . . . . . 0.453 HG23 ' HE1' ' A' ' 632' ' ' HIS . 38.3 mt -60.32 -51.39 73.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.048 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 4.7 ttpp -60.79 -32.82 72.15 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.249 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.67 -48.08 76.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.614 -179.507 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 632' ' ' HIS . . . . . 0.58 ' HB3' HD13 ' A' ' 717' ' ' LEU . 3.3 p-80 -69.47 -39.84 77.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.921 -179.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.512 HD13 ' SD ' ' A' ' 640' ' ' MET . 20.4 mt -55.86 -48.25 75.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.203 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 634' ' ' ARG . . . . . 0.433 ' HG3' ' N ' ' A' ' 635' ' ' SER . 0.1 OUTLIER -67.01 -39.92 87.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.719 0.295 . . . . 0.0 110.814 179.892 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 635' ' ' SER . . . . . 0.433 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 8.5 m -73.75 -14.03 61.06 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.42 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 636' ' ' GLN . . . . . 0.414 ' HB2' ' O ' ' A' ' 632' ' ' HIS . 0.0 OUTLIER -97.39 -8.26 29.91 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 -179.675 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 118.83 -8.46 12.86 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.583 179.696 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 638' ' ' ILE . . . . . 0.648 ' N ' HD12 ' A' ' 638' ' ' ILE . 3.5 mp -99.5 104.65 16.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 120.744 0.307 . . . . 0.0 111.03 -179.636 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 3.2 m -80.57 114.12 19.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.885 179.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 640' ' ' MET . . . . . 0.512 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.8 ttp -122.6 27.85 7.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.932 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.46 -52.8 59.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.888 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 642' ' ' GLU . . . . . 0.588 ' O ' HD12 ' A' ' 643' ' ' LEU . 0.6 OUTLIER -50.55 -72.39 0.05 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.23 -179.901 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 643' ' ' LEU . . . . . 0.588 HD12 ' O ' ' A' ' 642' ' ' GLU . 0.2 OUTLIER 179.67 134.4 0.25 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.81 179.843 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.13 122.96 7.47 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.455 2.103 . . . . 0.0 112.343 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 645' ' ' LEU . . . . . 0.612 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.9 tp -125.73 153.39 44.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.305 0.574 . . . . 0.0 111.319 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 646' ' ' ILE . . . . . 0.554 HD11 ' HA ' ' A' ' 695' ' ' LEU . 2.2 tt -149.62 133.17 7.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.448 179.156 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 50.59 43.61 45.97 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.246 -0.978 . . . . 0.0 112.138 -179.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 68.58 6.19 48.31 Favored Glycine 0 CA--C 1.52 0.378 0 C-N-CA 121.127 -0.559 . . . . 0.0 113.991 179.304 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 4.0 m -131.27 162.79 29.24 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 117.68 0.74 . . . . 0.0 111.696 -178.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 650' ' ' GLU . . . . . 0.612 ' HA ' HD12 ' A' ' 645' ' ' LEU . 2.5 mp0 -81.25 142.42 33.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.743 179.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 651' ' ' LEU . . . . . 0.644 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.11 144.76 48.78 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.071 0.462 . . . . 0.0 111.099 179.891 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.88 109.43 21.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.926 -179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -52.21 -42.62 63.69 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.083 -179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -62.78 -46.34 88.44 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.272 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 40.4 t -67.69 -37.58 82.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.911 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 656' ' ' PHE . . . . . 0.464 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.2 OUTLIER -68.82 -44.39 73.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.981 -179.898 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -59.96 -46.35 89.7 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.004 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.14 -43.89 98.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.009 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . 0.546 HD13 HD21 ' A' ' 682' ' ' LEU . 0.1 OUTLIER -56.7 -45.1 82.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.401 -179.65 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 660' ' ' ILE . . . . . 0.742 HG23 HG21 ' A' ' 669' ' ' VAL . 37.2 mt -62.97 -44.47 99.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.264 -179.845 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -64.3 -45.2 89.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.641 -179.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . 0.441 ' HG2' ' HA ' ' A' ' 659' ' ' LEU . 18.3 pt-20 -66.36 -14.15 61.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.598 -179.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.67 34.7 1.45 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.803 0.335 . . . . 0.0 111.199 -179.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 73.89 32.86 58.41 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.827 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 85.54 172.59 49.07 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.606 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 666' ' ' MET . . . . . 0.679 ' O ' HG22 ' A' ' 670' ' ' THR . 10.1 tpt -72.15 -28.87 63.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.643 0.259 . . . . 0.0 111.237 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 18.7 pt20 -55.07 -48.29 73.72 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.106 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 668' ' ' GLN . . . . . 0.4 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -63.0 -51.86 65.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.856 0.36 . . . . 0.0 110.812 179.949 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 669' ' ' VAL . . . . . 0.742 HG21 HG23 ' A' ' 660' ' ' ILE . 40.7 t -49.19 -55.31 4.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.722 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 670' ' ' THR . . . . . 0.679 HG22 ' O ' ' A' ' 666' ' ' MET . 9.7 t -76.02 -50.69 14.12 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -178.372 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 671' ' ' ASP . . . . . 0.471 ' N ' HG23 ' A' ' 670' ' ' THR . 40.0 m-20 -62.14 -51.27 68.55 Favored 'General case' 0 N--CA 1.464 0.273 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -177.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 672' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 4.4 mm? -78.0 3.55 14.47 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -179.16 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 1.7 mttt 49.07 86.43 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 120.996 0.427 . . . . 0.0 110.477 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 27.7 mttt -144.88 22.21 1.59 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.229 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 675' ' ' TRP . . . . . 1.116 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 36.6 m95 -61.21 -30.34 70.37 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 121.409 0.624 . . . . 0.0 110.173 179.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -57.02 -43.29 81.69 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.372 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -76.18 -51.52 11.96 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.802 0.334 . . . . 0.0 111.243 -179.615 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.973 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.84 -40.29 72.62 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.572 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 679' ' ' ALA . . . . . 0.835 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.6 -33.68 69.23 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.551 179.107 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -53.77 -49.51 68.09 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.363 179.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 5.4 mtp -62.73 -22.21 66.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.763 179.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 682' ' ' LEU . . . . . 0.546 HD21 HD13 ' A' ' 659' ' ' LEU . 3.2 mm? -79.28 -1.13 35.22 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.457 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . 0.776 ' C ' HD12 ' A' ' 684' ' ' ILE . 0.0 OUTLIER 70.63 71.93 0.2 Allowed 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.956 0.408 . . . . 0.0 111.343 179.98 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . 0.776 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.8 mp -124.43 136.99 28.45 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.682 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . 0.431 ' HD2' HG23 ' A' ' 684' ' ' ILE . 36.8 Cg_endo -65.99 125.2 13.75 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.474 2.116 . . . . 0.0 112.361 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.85 -13.94 62.51 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.393 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -65.3 -23.18 66.95 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.734 0.302 . . . . 0.0 111.207 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 688' ' ' ALA . . . . . 0.422 ' HB1' ' HG3' ' A' ' 691' ' ' ARG . . . -82.81 107.6 15.55 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.949 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -75.09 -68.33 0.56 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.206 -179.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 70.8 m-20 -54.6 -17.36 3.21 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.811 -179.696 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 691' ' ' ARG . . . . . 0.425 ' NH1' HG13 ' A' ' 684' ' ' ILE . 0.0 OUTLIER -45.93 -40.51 10.31 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.876 0.369 . . . . 0.0 111.299 179.859 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -59.69 -42.06 92.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.056 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.23 -37.23 69.21 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.892 0.377 . . . . 0.0 111.159 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -65.11 -42.96 93.47 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.29 179.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 1.116 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.4 OUTLIER -63.98 -43.91 94.31 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.422 179.67 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.445 ' O ' ' CD1' ' A' ' 699' ' ' TYR . 5.1 tp60 -56.17 -44.82 79.71 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.643 179.76 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -77.22 -29.8 54.32 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.176 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . 0.445 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.39 -37.53 83.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.729 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 699' ' ' TYR . . . . . 0.541 ' CZ ' ' HE2' ' A' ' 666' ' ' MET . 2.1 p90 -84.92 -37.62 20.35 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.969 0.414 . . . . 0.0 110.232 179.646 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 700' ' ' CYS . . . . . 0.642 ' HA ' HD23 ' A' ' 704' ' ' LEU . 15.3 t -60.88 -30.32 70.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.646 179.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -100.09 -0.42 39.06 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.453 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 702' ' ' TYR . . . . . 0.452 ' CZ ' HG21 ' A' ' 638' ' ' ILE . 5.1 m-85 -117.69 -79.05 0.59 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.78 0.324 . . . . 0.0 111.623 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 5.9 mp -64.41 -40.35 95.61 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.951 -179.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.642 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.4 OUTLIER -47.44 -56.63 6.6 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.806 0.336 . . . . 0.0 111.515 -179.593 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.28 -46.12 72.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.251 -179.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 706' ' ' TYR . . . . . 0.573 ' O ' HD22 ' A' ' 709' ' ' LEU . 10.2 t80 -61.95 -29.47 70.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.135 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -95.45 -4.46 45.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.497 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 8.6 p -112.52 -23.19 10.41 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.613 0.244 . . . . 0.0 111.378 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 709' ' ' LEU . . . . . 0.642 HD21 ' CD2' ' A' ' 714' ' ' HIS . 0.2 OUTLIER -70.15 172.61 7.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.812 0.339 . . . . 0.0 110.938 -179.942 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.6 165.57 51.86 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.098 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -68.42 -22.69 38.8 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.633 2.222 . . . . 0.0 112.191 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -52.3 -51.09 60.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.853 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 713' ' ' GLU . . . . . 0.552 ' HB2' HD11 ' A' ' 709' ' ' LEU . 1.6 mm-40 -57.96 -27.13 63.14 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.149 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 714' ' ' HIS . . . . . 0.642 ' CD2' HD21 ' A' ' 709' ' ' LEU . 24.8 m-70 -76.03 -53.8 7.81 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.669 179.61 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.53 -46.61 88.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.56 -179.44 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 716' ' ' ARG . . . . . 0.4 ' CG ' ' N ' ' A' ' 717' ' ' LEU . 4.7 ptt180 -67.54 -51.57 49.18 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.797 -179.188 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . 0.58 HD13 ' HB3' ' A' ' 632' ' ' HIS . 90.8 mt -64.57 -43.61 93.32 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.693 0.282 . . . . 0.0 111.072 -179.57 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . 0.62 ' HG3' HD23 ' A' ' 722' ' ' LEU . 10.8 tt0 -65.75 -54.17 30.73 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.242 179.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -50.46 -35.62 29.73 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.373 -179.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 720' ' ' GLU . . . . . 0.436 ' O ' ' HG2' ' A' ' 723' ' ' MET . 9.9 mt-10 -70.8 -55.47 8.49 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.933 0.397 . . . . 0.0 110.992 179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 721' ' ' VAL . . . . . 0.661 HG11 ' HB1' ' A' ' 627' ' ' ALA . 22.0 t -63.63 -55.17 24.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.168 -179.487 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . 0.62 HD23 ' HG3' ' A' ' 718' ' ' GLU . 3.7 mm? -53.38 -42.37 66.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.999 -179.272 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 723' ' ' MET . . . . . 0.579 ' O ' HD12 ' A' ' 727' ' ' ILE . 14.1 ptp -68.66 -38.82 80.71 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 120.38 -0.528 . . . . 0.0 109.98 179.563 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -57.77 -35.02 70.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.157 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 725' ' ' LYS . . . . . 0.436 ' HD2' ' CE2' ' A' ' 619' ' ' TRP . 0.7 OUTLIER -86.11 -34.69 20.57 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.497 -179.654 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 726' ' ' GLU . . . . . 0.416 ' N ' ' HG3' ' A' ' 725' ' ' LYS . 10.3 mt-10 -72.37 -51.67 19.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.901 0.381 . . . . 0.0 111.189 -179.64 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 727' ' ' ILE . . . . . 0.632 HG22 ' O ' ' A' ' 727' ' ' ILE . 4.2 mp -87.55 11.68 1.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.647 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 8.5 tp -55.23 -56.22 22.43 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.775 0.322 . . . . 0.0 111.261 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -56.92 -49.05 76.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.266 -179.603 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.324 -0.846 . . . . 0.0 110.905 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 112.533 -0.227 . . . . 0.0 112.533 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -70.03 -28.11 24.34 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.651 2.234 . . . . 0.0 112.285 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.13 163.14 13.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.883 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 89.04 107.71 1.11 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.461 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 2.8 m -147.88 101.88 3.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.894 0.378 . . . . 0.0 110.94 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 70.8 mt -108.94 -176.96 3.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.891 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -134.59 -79.84 0.13 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.555 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -121.47 -143.09 0.34 Allowed 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 110.572 -0.159 . . . . 0.0 110.572 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.3 149.06 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.91 0.386 . . . . 0.0 110.969 -179.861 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 619' ' ' TRP . . . . . 0.607 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.1 OUTLIER -98.82 -15.33 19.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.464 -179.831 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 118.22 166.45 13.74 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.49 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -70.31 -39.84 5.05 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.501 2.134 . . . . 0.0 112.363 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 622' ' ' ASN . . . . . 0.459 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 29.5 m-80 -63.78 -36.87 85.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.952 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 623' ' ' VAL . . . . . 0.46 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 48.6 t -68.64 -45.56 81.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.884 179.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 624' ' ' GLN . . . . . 0.561 ' HG2' HD21 ' A' ' 722' ' ' LEU . 27.7 tp60 -59.65 -36.92 77.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.527 179.713 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 625' ' ' ARG . . . . . 0.433 ' HD3' ' CE2' ' A' ' 657' ' ' PHE . 0.1 OUTLIER -63.36 -50.79 68.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.509 179.694 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 6.3 tt -67.16 -27.5 67.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.921 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -73.47 -42.97 61.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.287 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.02 -34.92 73.9 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.176 -179.802 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 629' ' ' ILE . . . . . . . . . . . . . 19.5 mt -68.94 -49.11 66.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.323 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.86 -35.8 81.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.589 -0.278 . . . . 0.0 110.932 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 631' ' ' LYS . . . . . 0.41 ' O ' ' HG2' ' A' ' 634' ' ' ARG . 0.1 OUTLIER -64.52 -44.08 92.0 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.993 0.425 . . . . 0.0 110.702 179.775 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 632' ' ' HIS . . . . . 0.458 ' CG ' HD11 ' A' ' 709' ' ' LEU . 35.7 t60 -69.64 -41.63 75.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.806 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.414 ' CD2' ' CD2' ' A' ' 702' ' ' TYR . 42.6 mt -57.14 -49.93 74.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.145 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 634' ' ' ARG . . . . . 0.41 ' HG2' ' O ' ' A' ' 631' ' ' LYS . 0.0 OUTLIER -62.32 -43.5 98.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.709 179.793 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.58 -14.1 61.54 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.33 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 7.2 tp-100 -96.5 -8.18 32.76 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 111.649 0.241 . . . . 0.0 111.649 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 115.13 0.43 22.46 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.52 179.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 638' ' ' ILE . . . . . 0.566 HG21 ' CZ ' ' A' ' 702' ' ' TYR . 14.7 mt -109.41 104.93 17.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 120.766 0.317 . . . . 0.0 111.192 -179.494 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 1.3 m -83.28 104.14 13.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.048 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 640' ' ' MET . . . . . 0.405 ' HE2' HD12 ' A' ' 633' ' ' LEU . 0.0 OUTLIER -98.28 25.96 5.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.818 179.854 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -78.06 -33.11 51.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.812 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -59.49 -73.4 0.09 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.84 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 643' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 179.13 118.41 0.21 Allowed Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.877 179.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -67.76 127.75 16.76 Favored 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.364 2.042 . . . . 0.0 111.967 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 645' ' ' LEU . . . . . 0.629 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.3 tp -142.68 152.54 42.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.407 0.623 . . . . 0.0 111.836 -179.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 646' ' ' ILE . . . . . 0.517 HD11 ' HA ' ' A' ' 695' ' ' LEU . 3.0 tt -149.86 133.53 8.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.552 178.772 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 51.59 41.75 50.25 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.223 -0.989 . . . . 0.0 112.222 -179.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.22 5.61 54.58 Favored Glycine 0 CA--C 1.521 0.466 0 C-N-CA 121.065 -0.588 . . . . 0.0 113.971 179.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.8 m -130.89 162.36 29.83 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 117.561 0.681 . . . . 0.0 111.66 -179.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 650' ' ' GLU . . . . . 0.629 ' HA ' HD12 ' A' ' 645' ' ' LEU . 1.6 mp0 -79.2 144.21 34.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.787 179.763 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 651' ' ' LEU . . . . . 0.635 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -135.25 144.98 47.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.098 0.475 . . . . 0.0 111.433 -179.737 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -95.71 111.15 23.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.821 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -52.23 -43.41 64.27 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.146 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 654' ' ' ALA . . . . . 0.459 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -59.25 -45.6 90.75 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.206 -179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 37.2 t -68.9 -33.9 74.53 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.756 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 656' ' ' PHE . . . . . 0.456 ' CE1' ' HB2' ' A' ' 651' ' ' LEU . 0.8 OUTLIER -68.54 -46.2 70.15 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.006 179.966 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 657' ' ' PHE . . . . . 0.433 ' CE2' ' HD3' ' A' ' 625' ' ' ARG . 75.7 t80 -60.82 -48.55 81.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.137 -179.816 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.13 -45.52 87.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.262 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . 0.847 HD13 ' CD2' ' A' ' 682' ' ' LEU . 0.1 OUTLIER -57.44 -51.0 71.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.547 -179.498 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 660' ' ' ILE . . . . . 0.734 HG23 HG21 ' A' ' 669' ' ' VAL . 53.3 mt -56.75 -44.54 81.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-O 120.751 0.31 . . . . 0.0 110.831 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -62.6 -45.13 94.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.786 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -64.48 -14.99 59.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.355 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 1.7 mmm -94.21 28.06 2.64 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.704 0.288 . . . . 0.0 111.214 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 76.03 33.94 48.68 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.641 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 87.23 171.91 47.71 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.535 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 666' ' ' MET . . . . . 0.575 ' O ' HG22 ' A' ' 670' ' ' THR . 10.7 tpt -70.73 -26.48 63.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.699 0.285 . . . . 0.0 111.218 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 667' ' ' GLN . . . . . 0.417 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 20.0 pt20 -58.3 -46.49 86.01 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.067 -179.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 668' ' ' GLN . . . . . 0.588 ' HA ' HD13 ' A' ' 672' ' ' LEU . 7.3 mm-40 -64.9 -52.75 54.77 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.901 0.382 . . . . 0.0 110.971 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 669' ' ' VAL . . . . . 0.734 HG21 HG23 ' A' ' 660' ' ' ILE . 47.5 t -49.13 -55.89 3.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.816 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 670' ' ' THR . . . . . 0.575 HG22 ' O ' ' A' ' 666' ' ' MET . 12.6 t -76.23 -47.3 24.44 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -178.394 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 671' ' ' ASP . . . . . 0.44 ' N ' HG23 ' A' ' 670' ' ' THR . 15.4 t0 -66.54 -51.14 59.76 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -177.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 672' ' ' LEU . . . . . 0.588 HD13 ' HA ' ' A' ' 668' ' ' GLN . 7.9 mp -76.08 1.93 14.24 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -179.08 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 6.1 tttp 49.87 84.2 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.024 0.44 . . . . 0.0 110.614 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.02 21.63 1.41 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.026 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 675' ' ' TRP . . . . . 1.112 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 31.1 m95 -59.16 -31.7 69.22 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.324 0.583 . . . . 0.0 110.219 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -54.56 -42.97 71.61 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.785 -179.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.97 -51.49 11.05 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-O 120.706 0.289 . . . . 0.0 111.565 -179.327 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 1.008 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.72 -42.52 75.41 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 179.813 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 679' ' ' ALA . . . . . 0.75 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.64 -33.15 68.68 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 120.84 0.352 . . . . 0.0 110.589 179.037 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.23 -49.32 67.05 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.532 179.601 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 7.0 mtm -64.08 -21.12 66.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.856 179.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 682' ' ' LEU . . . . . 0.847 ' CD2' HD13 ' A' ' 659' ' ' LEU . 2.9 mm? -78.96 -1.7 36.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.399 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . 0.809 ' C ' HD12 ' A' ' 684' ' ' ILE . 13.5 mmm180 73.17 71.7 0.13 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 121.0 0.428 . . . . 0.0 111.39 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . 0.809 HD12 ' C ' ' A' ' 683' ' ' ARG . 2.7 mp -131.72 140.35 38.01 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.135 179.557 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . 0.634 ' HD2' HG23 ' A' ' 684' ' ' ILE . 34.7 Cg_endo -65.1 123.09 11.06 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.518 2.145 . . . . 0.0 112.68 -179.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.79 -26.2 64.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.96 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 3.1 p -65.36 -21.6 66.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.095 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 688' ' ' ALA . . . . . . . . . . . . . . . -71.8 111.08 6.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.871 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 25.7 mm-40 -71.67 -68.92 0.42 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.093 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -52.94 -19.21 2.42 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.909 -179.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 691' ' ' ARG . . . . . 0.502 ' HD2' HG22 ' A' ' 684' ' ' ILE . 0.0 OUTLIER -53.4 -34.69 58.68 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.75 0.31 . . . . 0.0 110.726 179.753 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -70.33 -52.94 19.01 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.175 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -69.36 -36.48 76.9 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.357 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 2.0 tmmm? -63.81 -41.28 97.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.135 0.493 . . . . 0.0 110.003 179.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 1.112 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.7 OUTLIER -63.37 -44.92 93.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.421 179.533 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.42 ' O ' ' CD1' ' A' ' 699' ' ' TYR . 43.2 mt-30 -55.53 -44.82 77.06 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.744 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -77.34 -29.78 53.63 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.206 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . 0.409 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.12 -39.05 86.57 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.62 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 699' ' ' TYR . . . . . 0.492 ' CE2' ' HE2' ' A' ' 666' ' ' MET . 1.7 p90 -83.77 -37.49 22.54 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.017 0.437 . . . . 0.0 110.244 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 700' ' ' CYS . . . . . 0.503 ' HA ' HD23 ' A' ' 704' ' ' LEU . 1.3 m -59.95 -31.71 70.12 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.485 179.708 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.53 -11.06 32.8 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.223 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 702' ' ' TYR . . . . . 0.566 ' CZ ' HG21 ' A' ' 638' ' ' ILE . 4.0 m-85 -114.44 -76.56 0.58 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.9 0.381 . . . . 0.0 111.405 -179.451 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -54.66 -49.85 69.61 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.733 -179.361 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.503 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.5 OUTLIER -49.61 -45.45 48.13 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.851 0.357 . . . . 0.0 111.353 -179.607 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 2.3 m -55.38 -55.27 33.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.731 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 706' ' ' TYR . . . . . 0.478 ' HA ' HD12 ' A' ' 709' ' ' LEU . 71.5 t80 -64.59 -30.42 71.45 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.018 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -78.6 -18.62 54.29 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.423 -179.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 1.7 t -93.13 -19.89 21.04 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.785 0.326 . . . . 0.0 110.97 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 709' ' ' LEU . . . . . 0.741 HD22 ' CB ' ' A' ' 713' ' ' GLU . 49.6 mt -51.48 141.51 15.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.555 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 710' ' ' SER . . . . . 0.439 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.5 OUTLIER -78.03 167.97 31.39 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.5 179.586 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . 0.439 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 9.2 Cg_endo -52.58 -22.91 18.05 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.517 2.145 . . . . 0.0 112.374 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -75.98 -55.89 5.18 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.982 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 713' ' ' GLU . . . . . 0.741 ' CB ' HD22 ' A' ' 709' ' ' LEU . 2.3 mm-40 -58.54 -27.26 64.37 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.021 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 8.7 m-70 -75.85 -53.96 7.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.432 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.05 -36.48 83.72 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.148 -179.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.43 -54.36 21.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.827 0.346 . . . . 0.0 111.089 -179.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . 0.414 ' O ' HG23 ' A' ' 721' ' ' VAL . 83.6 mt -64.42 -40.62 96.12 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.712 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . 0.557 ' HG3' HD23 ' A' ' 722' ' ' LEU . 24.4 tt0 -67.33 -54.03 24.28 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.398 179.631 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 13.0 mmtt -50.72 -35.01 29.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.315 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 720' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' A' ' 723' ' ' MET . 10.4 mt-10 -67.77 -55.61 12.4 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.993 0.425 . . . . 0.0 110.544 179.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 721' ' ' VAL . . . . . 0.607 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 33.2 t -63.75 -54.73 28.42 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.106 -179.691 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . 0.764 HD13 ' HE2' ' A' ' 725' ' ' LYS . 0.8 OUTLIER -49.06 -44.03 41.4 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.874 -179.31 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 723' ' ' MET . . . . . 0.537 ' HB2' HD13 ' A' ' 727' ' ' ILE . 16.9 ptp -72.77 -39.9 66.4 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.608 -0.437 . . . . 0.0 110.15 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -50.86 -41.83 58.34 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.64 -179.305 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 725' ' ' LYS . . . . . 0.764 ' HE2' HD13 ' A' ' 722' ' ' LEU . 0.0 OUTLIER -86.08 -36.82 19.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.686 0.279 . . . . 0.0 111.315 -179.751 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -62.48 -53.61 52.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.989 0.423 . . . . 0.0 110.945 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 727' ' ' ILE . . . . . 0.655 HG22 ' O ' ' A' ' 727' ' ' ILE . 4.6 mp -88.49 11.57 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.552 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 8.7 tt -56.79 -34.17 67.38 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.774 0.321 . . . . 0.0 110.995 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -90.53 -48.32 7.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.938 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 22.6 mtmt . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.852 -179.966 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.227 0 N-CA-C 112.471 -0.252 . . . . 0.0 112.471 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -71.73 -30.02 15.02 Favored 'Trans proline' 0 C--N 1.344 0.309 0 C-N-CA 122.579 2.186 . . . . 0.0 112.347 179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 2.7 mt -63.39 171.22 2.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.857 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 116.43 48.37 0.47 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.409 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 13.2 m -117.46 31.13 6.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.804 0.335 . . . . 0.0 110.909 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 3.2 mt -92.34 166.37 12.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.837 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -174.11 60.61 0.13 Allowed Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.476 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -83.98 -1.8 55.36 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.202 0.525 . . . . 0.0 111.505 179.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.92 139.99 43.7 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.858 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 619' ' ' TRP . . . . . 0.553 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.1 OUTLIER -57.49 -20.93 34.31 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.297 -179.975 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 123.55 164.96 12.17 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.829 -0.701 . . . . 0.0 112.329 -179.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -65.64 -40.8 16.56 Favored 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 122.453 2.102 . . . . 0.0 112.191 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 622' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -59.85 -43.25 94.76 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.918 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 623' ' ' VAL . . . . . 0.452 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 38.3 t -71.54 -38.05 66.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.913 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 624' ' ' GLN . . . . . 0.669 ' CG ' HD11 ' A' ' 722' ' ' LEU . 3.2 tm0? -54.3 -45.39 72.54 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.661 179.787 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 8.3 mtt180 -70.68 -39.77 73.33 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.343 179.423 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 626' ' ' LEU . . . . . 0.8 ' O ' HD13 ' A' ' 626' ' ' LEU . 3.1 tm? -63.28 -32.27 73.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.768 179.663 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . 0.496 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -72.9 -48.26 38.7 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.114 -0.493 . . . . 0.0 111.319 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -57.03 -46.56 82.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.951 -179.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 629' ' ' ILE . . . . . 0.428 HG22 ' CD1' ' A' ' 633' ' ' LEU . 10.4 mt -66.38 -38.95 82.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.929 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 15.5 ttpt -64.22 -39.52 94.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.935 179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.13 -42.41 89.17 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.817 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 632' ' ' HIS . . . . . 0.866 ' CE1' HD11 ' A' ' 709' ' ' LEU . 84.1 t60 -70.52 -41.44 72.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.796 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.428 ' CD1' HG22 ' A' ' 629' ' ' ILE . 49.7 mt -58.27 -49.73 76.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.291 -179.718 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 634' ' ' ARG . . . . . 0.442 ' HG3' ' N ' ' A' ' 635' ' ' SER . 3.8 ptt180 -65.79 -38.77 89.91 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.983 -179.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 635' ' ' SER . . . . . 0.442 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 0.3 OUTLIER -73.71 -20.38 60.55 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.091 179.77 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 636' ' ' GLN . . . . . 0.423 ' CG ' ' CE1' ' A' ' 632' ' ' HIS . 32.4 mm-40 -88.93 -5.25 58.11 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.665 -179.661 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 109.97 -0.85 30.09 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.418 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 638' ' ' ILE . . . . . 0.511 HG21 ' CE2' ' A' ' 702' ' ' TYR . 13.9 mt -103.21 104.62 16.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.409 0 CA-C-O 120.703 0.287 . . . . 0.0 111.127 -179.612 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.11 108.43 17.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.899 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 640' ' ' MET . . . . . . . . . . . . . 1.6 mtp -119.87 28.6 8.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.864 179.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -60.99 -33.0 72.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.835 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 11.6 mt-10 -67.48 -78.62 0.06 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.904 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 643' ' ' LEU . . . . . 0.488 HD13 ' OE2' ' A' ' 650' ' ' GLU . 0.7 OUTLIER 178.06 129.81 0.21 Allowed Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.901 179.888 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 644' ' ' PRO . . . . . 0.466 ' HB2' HD11 ' A' ' 651' ' ' LEU . 57.1 Cg_endo -70.98 130.86 18.49 Favored 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.413 2.075 . . . . 0.0 112.223 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 645' ' ' LEU . . . . . 0.62 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.4 tp -124.12 151.78 43.53 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.272 0.558 . . . . 0.0 111.455 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 646' ' ' ILE . . . . . 0.548 HG22 ' HB3' ' A' ' 651' ' ' LEU . 0.8 OUTLIER -149.66 132.9 7.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.614 178.982 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.21 40.95 60.69 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.304 -179.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.08 5.43 58.54 Favored Glycine 0 C--N 1.334 0.439 0 C-N-CA 120.989 -0.624 . . . . 0.0 113.875 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -132.26 163.79 27.83 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 117.447 0.624 . . . . 0.0 111.432 -179.115 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 650' ' ' GLU . . . . . 0.62 ' HA ' HD12 ' A' ' 645' ' ' LEU . 3.6 mt-10 -79.29 145.74 33.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.822 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 651' ' ' LEU . . . . . 0.584 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -135.69 145.05 46.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.11 0.481 . . . . 0.0 111.599 -179.57 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -95.91 112.33 24.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.97 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 653' ' ' LEU . . . . . . . . . . . . . 6.7 mp -61.08 -33.78 73.89 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.076 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 654' ' ' ALA . . . . . . . . . . . . . . . -64.58 -47.57 78.21 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.935 0.398 . . . . 0.0 110.942 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 53.3 t -70.34 -33.07 71.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.271 179.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 656' ' ' PHE . . . . . 0.47 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.3 OUTLIER -69.1 -46.28 68.15 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.569 179.624 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -58.17 -52.76 64.2 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.091 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -57.84 -41.34 82.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.823 0.344 . . . . 0.0 110.789 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . 0.572 HD21 ' CE ' ' A' ' 681' ' ' MET . 0.2 OUTLIER -55.03 -46.0 75.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.124 179.93 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 660' ' ' ILE . . . . . 0.708 HD11 ' CH2' ' A' ' 675' ' ' TRP . 12.6 mt -63.2 -42.33 96.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.045 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -62.21 -46.15 90.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.114 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 71.4 tt0 -72.86 -9.54 58.8 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.474 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 1.4 mmm -95.03 36.66 1.19 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.765 0.317 . . . . 0.0 111.125 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 66.91 38.43 92.89 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.364 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 79.96 172.23 43.76 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.791 -0.718 . . . . 0.0 112.453 -179.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 666' ' ' MET . . . . . 0.792 ' O ' HG22 ' A' ' 670' ' ' THR . 9.7 tpt -72.15 -27.19 62.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.654 0.264 . . . . 0.0 111.256 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -57.53 -48.85 78.17 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.437 -179.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 668' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -63.19 -42.87 99.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.837 0.351 . . . . 0.0 111.296 -179.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 669' ' ' VAL . . . . . 0.651 HG12 ' CD1' ' A' ' 675' ' ' TRP . 40.2 t -61.81 -53.35 49.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.785 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 670' ' ' THR . . . . . 0.792 HG22 ' O ' ' A' ' 666' ' ' MET . 10.1 t -75.75 -49.66 17.53 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -178.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 671' ' ' ASP . . . . . 0.436 ' N ' HG23 ' A' ' 670' ' ' THR . 51.2 m-20 -63.09 -51.01 68.28 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -178.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 672' ' ' LEU . . . . . . . . . . . . . 22.6 mt -87.04 10.87 15.17 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 111.895 0.332 . . . . 0.0 111.895 -179.362 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 10.5 ttpp 46.67 77.19 0.09 Allowed 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 120.929 0.395 . . . . 0.0 110.506 -179.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.52 6.71 14.74 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.706 -179.371 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 675' ' ' TRP . . . . . 0.795 ' HA ' HD22 ' A' ' 678' ' ' LEU . 77.1 m95 -65.05 -22.73 67.02 Favored 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 120.464 -0.494 . . . . 0.0 110.7 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -59.16 -51.68 68.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.845 0.355 . . . . 0.0 111.022 -179.519 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 5.1 tptt -78.0 -47.18 19.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.167 0.508 . . . . 0.0 110.193 179.402 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.795 HD22 ' HA ' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -52.97 -46.41 68.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.176 179.297 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 679' ' ' ALA . . . . . 0.655 ' O ' HD13 ' A' ' 684' ' ' ILE . . . -71.27 -35.68 71.45 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.213 179.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -52.87 -48.08 67.37 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.778 0.323 . . . . 0.0 110.863 -179.852 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 681' ' ' MET . . . . . 0.572 ' CE ' HD21 ' A' ' 659' ' ' LEU . 1.8 ttp -65.3 -20.69 66.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.861 179.527 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 682' ' ' LEU . . . . . 0.467 ' HG ' ' CE2' ' A' ' 656' ' ' PHE . 2.1 mm? -80.06 -3.43 48.54 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.523 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . 0.808 ' C ' HD12 ' A' ' 684' ' ' ILE . 0.5 OUTLIER 74.89 71.72 0.1 Allowed 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.936 0.398 . . . . 0.0 111.318 179.874 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . 0.808 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.8 mp -125.13 138.1 30.98 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.21 179.631 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . 0.505 ' HD2' HG23 ' A' ' 684' ' ' ILE . 41.1 Cg_endo -68.42 121.32 8.26 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.364 2.043 . . . . 0.0 112.567 -179.654 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 686' ' ' LYS . . . . . 0.571 ' NZ ' HG23 ' A' ' 687' ' ' THR . 3.0 pptp? -69.76 -18.71 63.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.184 179.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 687' ' ' THR . . . . . 0.571 HG23 ' NZ ' ' A' ' 686' ' ' LYS . 0.2 OUTLIER -65.23 -20.47 66.44 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.299 -179.766 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 688' ' ' ALA . . . . . 0.761 ' HB3' ' HG2' ' A' ' 691' ' ' ARG . . . -65.02 117.65 7.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.899 0.381 . . . . 0.0 110.87 179.778 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.13 7.83 14.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.557 -180.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -138.84 -0.19 1.93 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.442 179.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 691' ' ' ARG . . . . . 0.761 ' HG2' ' HB3' ' A' ' 688' ' ' ALA . 2.5 ptt180 -56.48 -33.94 66.45 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-O 120.764 0.316 . . . . 0.0 111.068 -179.585 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . 0.707 ' O ' HD23 ' A' ' 695' ' ' LEU . 0.5 OUTLIER -70.17 -53.09 18.67 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.927 0.394 . . . . 0.0 110.996 -179.943 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.98 -37.18 69.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.828 0.346 . . . . 0.0 111.565 -179.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -63.44 -41.29 98.67 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.361 -179.495 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 0.713 HD11 ' HB3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -72.95 -40.01 65.73 Favored 'General case' 0 C--N 1.329 -0.287 0 C-N-CA 120.969 -0.293 . . . . 0.0 110.654 179.972 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.509 ' N ' HD23 ' A' ' 695' ' ' LEU . 0.0 OUTLIER -55.33 -44.6 76.02 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.29 0.567 . . . . 0.0 109.752 179.126 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -77.6 -29.46 51.92 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.754 179.075 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . 0.415 ' HB3' ' HA ' ' A' ' 695' ' ' LEU . . . -66.78 -40.68 88.26 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.878 -179.647 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 699' ' ' TYR . . . . . 0.558 ' CE2' HD23 ' A' ' 704' ' ' LEU . 2.6 p90 -80.82 -40.4 25.02 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.833 0.349 . . . . 0.0 110.441 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 700' ' ' CYS . . . . . 0.439 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 0.7 OUTLIER -58.86 -33.03 70.0 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.784 179.909 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -94.4 -4.57 48.17 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.68 -179.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 702' ' ' TYR . . . . . 0.511 ' CE2' HG21 ' A' ' 638' ' ' ILE . 8.3 m-85 -123.3 -76.58 0.59 Allowed 'General case' 0 C--O 1.231 0.126 0 CA-C-O 120.791 0.329 . . . . 0.0 111.38 -179.786 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 703' ' ' LEU . . . . . 0.433 HD13 HD12 ' A' ' 660' ' ' ILE . 25.5 mt -56.31 -45.95 80.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.488 -179.356 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.558 HD23 ' CE2' ' A' ' 699' ' ' TYR . 0.4 OUTLIER -47.62 -54.34 12.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.956 0.407 . . . . 0.0 111.284 -179.792 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . 0.415 ' O ' ' HG ' ' A' ' 709' ' ' LEU . 0.1 OUTLIER -54.57 -48.34 72.2 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.97 -179.846 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 706' ' ' TYR . . . . . 0.524 ' HA ' HD12 ' A' ' 709' ' ' LEU . 46.6 t80 -64.51 -31.61 72.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.052 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -79.57 -16.28 56.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.306 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -97.44 -19.75 18.22 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.771 0.319 . . . . 0.0 111.13 -179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 709' ' ' LEU . . . . . 0.866 HD11 ' CE1' ' A' ' 632' ' ' HIS . 45.7 mt -55.31 151.36 9.9 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.998 0.428 . . . . 0.0 111.466 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 710' ' ' SER . . . . . 0.429 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.3 OUTLIER -80.05 171.73 11.66 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.597 179.753 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . 0.429 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 60.1 Cg_endo -72.38 -6.75 19.67 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.494 2.129 . . . . 0.0 112.862 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -74.57 -56.62 4.63 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.854 0.359 . . . . 0.0 110.943 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 713' ' ' GLU . . . . . 0.741 ' OE1' HD13 ' A' ' 709' ' ' LEU . 2.8 pp20? -61.06 -25.79 67.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.033 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 714' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -73.23 -54.1 9.26 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.167 179.571 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 26.5 ttt180 -60.13 -40.69 90.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.11 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.47 -53.94 12.28 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.324 -179.702 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . 0.566 HD12 ' OE1' ' A' ' 713' ' ' GLU . 76.8 mt -60.6 -43.26 97.62 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.863 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . 0.724 ' HG3' HD13 ' A' ' 722' ' ' LEU . 36.3 tt0 -63.86 -54.03 41.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.361 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 10.8 mmtt -50.38 -35.07 26.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.292 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 720' ' ' GLU . . . . . 0.44 ' O ' ' HG2' ' A' ' 723' ' ' MET . 1.5 mm-40 -70.39 -55.31 9.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.981 0.419 . . . . 0.0 110.93 179.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 721' ' ' VAL . . . . . 0.553 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 39.2 t -63.77 -55.15 24.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.179 -179.568 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . 0.724 HD13 ' HG3' ' A' ' 718' ' ' GLU . 7.1 mp -53.48 -41.94 66.75 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.1 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 723' ' ' MET . . . . . 0.59 ' O ' HD12 ' A' ' 727' ' ' ILE . 5.8 ptp -68.92 -38.83 79.79 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.052 179.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 724' ' ' GLU . . . . . 0.405 ' N ' ' HG3' ' A' ' 723' ' ' MET . 2.0 mt-10 -59.68 -35.38 74.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.145 -179.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 725' ' ' LYS . . . . . 0.447 ' HD3' ' CE2' ' A' ' 619' ' ' TRP . 10.0 pttt -86.15 -37.8 18.37 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.433 -179.663 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 726' ' ' GLU . . . . . 0.405 ' N ' ' HG3' ' A' ' 725' ' ' LYS . 3.5 mm-40 -70.11 -50.42 40.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.308 -179.524 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 727' ' ' ILE . . . . . 0.647 HG22 ' O ' ' A' ' 727' ' ' ILE . 4.1 mp -88.09 11.64 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.697 -179.765 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 2.8 tt -57.68 -35.73 70.97 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.835 0.35 . . . . 0.0 110.952 179.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -63.04 -51.52 66.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.994 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 3.6 mtpt . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.18 -0.914 . . . . 0.0 110.927 -179.941 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.206 0 N-CA-C 112.457 -0.257 . . . . 0.0 112.457 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.59 -28.48 26.04 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.558 2.172 . . . . 0.0 112.291 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 3.1 mt -82.87 177.69 8.52 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.928 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . 95.58 -24.38 29.63 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.608 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 29.2 t 62.91 79.88 0.25 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.806 0.336 . . . . 0.0 110.98 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 615' ' ' LEU . . . . . 0.683 HD13 ' OE1' ' A' ' 729' ' ' GLU . 22.8 mt -68.19 174.31 4.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.862 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 85.3 74.33 1.26 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.506 -179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -84.12 -1.5 55.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.133 0.492 . . . . 0.0 111.429 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 5.6 mtp180 64.41 130.85 0.02 OUTLIER 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.873 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 619' ' ' TRP . . . . . 0.551 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.0 OUTLIER -55.41 -22.53 20.5 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.275 -179.913 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 126.99 169.49 12.72 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.424 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -69.19 -33.65 18.27 Favored 'Trans proline' 0 C--N 1.344 0.319 0 C-N-CA 122.589 2.193 . . . . 0.0 112.195 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 622' ' ' ASN . . . . . 0.556 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 46.6 m-80 -68.25 -43.34 78.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.849 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 623' ' ' VAL . . . . . 0.492 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 38.6 t -71.85 -39.58 67.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.897 179.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 624' ' ' GLN . . . . . 0.64 ' CG ' HD11 ' A' ' 722' ' ' LEU . 1.9 tm0? -56.55 -50.39 72.03 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.868 179.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 625' ' ' ARG . . . . . 0.437 ' NH2' HD11 ' A' ' 629' ' ' ILE . 6.9 mmm180 -64.44 -43.39 94.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.769 179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 626' ' ' LEU . . . . . 0.619 ' O ' HD23 ' A' ' 626' ' ' LEU . 4.1 tt -59.65 -36.93 77.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.046 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . 0.41 ' CB ' HG11 ' A' ' 721' ' ' VAL . . . -72.36 -45.8 58.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.365 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -57.1 -47.11 81.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.167 -179.77 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 629' ' ' ILE . . . . . 0.437 HD11 ' NH2' ' A' ' 625' ' ' ARG . 8.5 mt -65.74 -42.49 92.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.098 -179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.75 -45.16 91.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.169 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 2.1 tttp -59.8 -43.86 94.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.19 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 632' ' ' HIS . . . . . 0.704 ' HB2' HD13 ' A' ' 717' ' ' LEU . 86.3 t60 -68.91 -40.89 78.86 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.119 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.455 HD12 ' CE ' ' A' ' 640' ' ' MET . 46.2 mt -57.49 -47.46 81.87 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.171 -179.737 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -64.14 -43.25 95.82 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.827 0.346 . . . . 0.0 110.605 179.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 20.2 m -73.67 -11.74 60.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.303 179.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 636' ' ' GLN . . . . . 0.403 ' HG3' ' NE2' ' A' ' 632' ' ' HIS . 32.2 mm-40 -97.46 -9.6 26.93 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.654 -179.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 118.57 -8.7 13.25 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.268 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 638' ' ' ILE . . . . . 0.502 HG21 ' CZ ' ' A' ' 702' ' ' TYR . 10.4 mt -100.57 104.64 16.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.649 0.261 . . . . 0.0 111.001 -179.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.82 109.49 15.42 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.086 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 640' ' ' MET . . . . . 0.455 ' CE ' HD12 ' A' ' 633' ' ' LEU . 1.6 mtm -113.64 25.15 11.49 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.82 179.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.98 -47.76 49.82 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.865 -179.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 642' ' ' GLU . . . . . 0.773 ' O ' HD12 ' A' ' 643' ' ' LEU . 0.2 OUTLIER -49.59 -72.6 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.096 -179.938 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 643' ' ' LEU . . . . . 0.773 HD12 ' O ' ' A' ' 642' ' ' GLU . 0.0 OUTLIER -178.05 117.66 0.25 Allowed Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.821 179.86 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -67.97 119.82 6.83 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.393 2.062 . . . . 0.0 112.097 179.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 645' ' ' LEU . . . . . 0.516 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.4 tp -131.15 154.96 47.8 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.402 0.62 . . . . 0.0 111.651 -179.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 646' ' ' ILE . . . . . 0.559 HD11 ' HA ' ' A' ' 695' ' ' LEU . 2.3 tt -149.94 134.2 8.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.54 178.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 50.14 41.65 38.9 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.214 -0.993 . . . . 0.0 112.12 -179.343 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 70.16 5.74 54.74 Favored Glycine 0 CA--C 1.522 0.507 0 C-N-CA 121.025 -0.607 . . . . 0.0 113.812 179.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -131.82 162.54 30.32 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 117.553 0.677 . . . . 0.0 111.541 -179.089 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 650' ' ' GLU . . . . . 0.516 ' HA ' HD12 ' A' ' 645' ' ' LEU . 5.2 mt-10 -81.38 144.33 31.52 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.85 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 651' ' ' LEU . . . . . 0.617 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.78 145.07 48.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.191 179.988 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -95.27 110.41 22.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.883 -179.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 653' ' ' LEU . . . . . 0.444 HD22 ' CD2' ' A' ' 651' ' ' LEU . 4.0 mm? -52.85 -36.07 58.35 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.025 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 654' ' ' ALA . . . . . 0.556 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -69.31 -47.09 65.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.042 179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 19.3 t -65.91 -41.78 91.0 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.629 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 656' ' ' PHE . . . . . 0.423 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.1 OUTLIER -67.37 -44.13 79.72 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.739 179.805 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -56.52 -51.71 67.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.885 179.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 11.2 ttt180 -58.58 -40.85 84.31 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.773 179.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . 0.49 HD12 ' HB2' ' A' ' 678' ' ' LEU . 0.2 OUTLIER -55.61 -45.62 77.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.102 -179.947 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 660' ' ' ILE . . . . . 0.715 HG23 HG21 ' A' ' 669' ' ' VAL . 33.0 mt -66.11 -44.27 91.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.265 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 17.8 t-20 -61.25 -41.51 97.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.386 -179.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -72.3 -10.34 59.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.61 -179.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.74 36.58 1.38 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.76 0.314 . . . . 0.0 111.186 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 68.63 28.81 72.91 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.628 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 92.32 171.37 41.26 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.593 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 666' ' ' MET . . . . . 0.575 ' SD ' HG21 ' A' ' 660' ' ' ILE . 10.6 tpt -71.59 -30.87 66.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.758 0.313 . . . . 0.0 111.254 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -55.15 -44.92 75.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.139 -179.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 668' ' ' GLN . . . . . 0.417 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -65.23 -52.19 56.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.898 0.38 . . . . 0.0 110.942 179.922 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 669' ' ' VAL . . . . . 0.715 HG21 HG23 ' A' ' 660' ' ' ILE . 48.7 t -49.02 -54.75 4.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.592 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 670' ' ' THR . . . . . 0.565 HG22 ' O ' ' A' ' 666' ' ' MET . 12.9 t -76.22 -50.68 13.83 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 113.468 0.914 . . . . 0.0 113.468 -178.59 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 671' ' ' ASP . . . . . 0.473 ' N ' HG23 ' A' ' 670' ' ' THR . 70.0 m-20 -61.18 -51.18 70.09 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 112.82 0.674 . . . . 0.0 112.82 -177.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 672' ' ' LEU . . . . . 0.417 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 10.4 mp -76.22 1.62 15.42 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -178.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 2.9 mmmt 50.14 85.19 0.03 OUTLIER 'General case' 0 C--O 1.232 0.138 0 CA-C-O 121.042 0.448 . . . . 0.0 110.387 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 7.4 mtmt -147.88 19.88 1.14 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.209 -179.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 675' ' ' TRP . . . . . 1.146 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 26.4 m95 -55.77 -29.24 59.31 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-O 121.428 0.632 . . . . 0.0 110.199 179.816 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -57.34 -42.9 82.87 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.684 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 11.1 mmtp -76.32 -51.83 11.18 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 111.668 0.248 . . . . 0.0 111.668 -179.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 1.046 HD21 ' CE3' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -57.32 -41.3 79.68 Favored 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 179.528 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 679' ' ' ALA . . . . . 0.782 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.72 -30.01 65.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.208 178.779 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -55.44 -51.56 66.53 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.295 179.57 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -60.53 -22.5 63.68 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.644 179.405 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 682' ' ' LEU . . . . . 0.413 ' HB2' ' O ' ' A' ' 679' ' ' ALA . 2.5 mm? -78.89 -2.2 38.74 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.445 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . 0.739 ' C ' HD12 ' A' ' 684' ' ' ILE . 1.1 mmt180 71.88 71.85 0.16 Allowed 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.962 0.41 . . . . 0.0 110.867 -179.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . 0.739 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.7 mp -122.56 135.76 25.96 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.927 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -66.29 122.59 10.11 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.418 2.078 . . . . 0.0 112.3 -179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 1.5 mmtm -70.0 -17.28 63.27 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.245 179.804 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 1.1 p -65.46 -22.81 66.79 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.321 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 688' ' ' ALA . . . . . 0.471 ' HB1' ' HG3' ' A' ' 691' ' ' ARG . . . -84.58 105.18 15.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.871 0.367 . . . . 0.0 110.905 179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 -70.49 -68.46 0.43 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.181 -179.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -52.76 -19.55 2.54 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.871 -179.583 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 691' ' ' ARG . . . . . 0.471 ' HG3' ' HB1' ' A' ' 688' ' ' ALA . 0.0 OUTLIER -48.09 -37.1 14.45 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.856 0.36 . . . . 0.0 111.171 179.922 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -64.23 -42.97 96.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.006 179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.05 -36.78 69.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.971 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 3.5 tttt -65.67 -41.69 92.2 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.128 179.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 1.146 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.2 OUTLIER -64.59 -41.93 95.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.279 179.51 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.461 ' O ' ' CD1' ' A' ' 699' ' ' TYR . 0.0 OUTLIER -57.85 -44.16 86.36 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.663 179.706 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -77.37 -29.79 53.47 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.128 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . 0.437 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.39 -37.68 83.49 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.716 -179.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 699' ' ' TYR . . . . . 0.549 ' CZ ' ' HE2' ' A' ' 666' ' ' MET . 2.1 p90 -84.26 -39.06 19.73 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.945 0.402 . . . . 0.0 110.305 179.689 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 700' ' ' CYS . . . . . 0.446 ' HA ' HD23 ' A' ' 704' ' ' LEU . 13.7 t -60.03 -30.54 69.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.567 179.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -97.89 -3.49 38.49 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.451 179.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 702' ' ' TYR . . . . . 0.502 ' CZ ' HG21 ' A' ' 638' ' ' ILE . 5.3 m-85 -117.98 -74.94 0.59 Allowed 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 120.862 0.363 . . . . 0.0 111.278 -179.719 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 703' ' ' LEU . . . . . 0.598 ' CD2' HD12 ' A' ' 660' ' ' ILE . 1.1 mp -60.91 -46.8 89.21 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.677 -179.263 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.447 HD23 ' CE2' ' A' ' 699' ' ' TYR . 0.7 OUTLIER -52.76 -50.76 62.86 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.925 0.393 . . . . 0.0 111.072 -179.812 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . 0.565 ' O ' HD13 ' A' ' 709' ' ' LEU . 0.3 OUTLIER -54.6 -54.84 36.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.719 179.935 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 706' ' ' TYR . . . . . 0.497 ' CE2' ' CE1' ' A' ' 714' ' ' HIS . 23.8 t80 -47.18 -43.12 20.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.97 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -93.79 -0.82 55.67 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -179.246 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.06 -16.43 56.8 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -179.453 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 709' ' ' LEU . . . . . 0.583 ' H ' HD13 ' A' ' 709' ' ' LEU . 0.0 OUTLIER -95.71 -173.35 2.84 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.833 0.349 . . . . 0.0 111.51 -179.642 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 710' ' ' SER . . . . . 0.416 ' O ' HD23 ' A' ' 709' ' ' LEU . 0.3 OUTLIER -86.71 165.47 32.35 Favored Pre-proline 0 C--N 1.332 -0.158 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.192 -179.705 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . 0.402 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 14.5 Cg_endo -56.87 -18.78 28.93 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.772 2.315 . . . . 0.0 112.972 -179.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -60.04 -54.16 49.24 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.93 0.395 . . . . 0.0 110.81 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 713' ' ' GLU . . . . . 0.455 ' HB2' ' HG ' ' A' ' 709' ' ' LEU . 2.7 mm-40 -61.28 -25.93 67.43 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.932 179.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 714' ' ' HIS . . . . . 0.497 ' CE1' ' CE2' ' A' ' 706' ' ' TYR . 0.2 OUTLIER -75.59 -54.06 7.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.254 179.529 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 22.5 ttt85 -66.22 -34.12 77.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.202 -179.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 3.0 ttt180 -67.79 -54.28 20.43 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.841 0.353 . . . . 0.0 110.983 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . 0.704 HD13 ' HB2' ' A' ' 632' ' ' HIS . 29.7 mt -64.62 -34.98 79.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.449 179.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . 0.62 ' HG3' HD13 ' A' ' 722' ' ' LEU . 28.3 tt0 -69.81 -53.81 16.52 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.405 179.599 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -53.48 -33.41 54.19 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.562 -179.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 720' ' ' GLU . . . . . 0.452 ' O ' ' HG2' ' A' ' 723' ' ' MET . 13.8 mt-10 -70.56 -55.73 8.18 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.036 0.446 . . . . 0.0 110.498 179.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 721' ' ' VAL . . . . . 0.551 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 41.4 t -61.66 -51.58 71.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.013 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . 0.64 HD11 ' CG ' ' A' ' 624' ' ' GLN . 9.0 mp -56.47 -38.56 71.87 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.921 -179.188 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 723' ' ' MET . . . . . 0.605 ' O ' HD12 ' A' ' 727' ' ' ILE . 16.1 ptp -74.67 -41.34 60.46 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 120.467 -0.493 . . . . 0.0 109.954 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 724' ' ' GLU . . . . . 0.432 ' N ' ' HG3' ' A' ' 723' ' ' MET . 1.6 mm-40 -56.87 -30.65 64.06 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.156 -179.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 725' ' ' LYS . . . . . 0.447 ' HD3' ' CZ2' ' A' ' 619' ' ' TRP . 15.0 pttt -86.19 -43.52 12.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.256 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -66.38 -51.55 55.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.082 -179.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 727' ' ' ILE . . . . . 0.632 HG22 ' O ' ' A' ' 727' ' ' ILE . 3.9 mp -87.83 11.66 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.667 -179.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 5.4 tt -52.64 -34.0 49.4 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.829 0.347 . . . . 0.0 111.142 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 729' ' ' GLU . . . . . 0.683 ' OE1' HD13 ' A' ' 615' ' ' LEU . 12.6 mt-10 -83.57 -55.59 4.2 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.891 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 27.3 mtmm . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.27 -0.871 . . . . 0.0 110.932 -179.961 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.203 0 N-CA-C 112.549 -0.22 . . . . 0.0 112.549 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -69.92 -28.74 24.12 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 122.568 2.179 . . . . 0.0 112.295 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 3.0 mt -69.74 149.35 48.09 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.923 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . -83.47 -139.55 3.81 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.526 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 4.9 m 60.24 97.97 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.852 0.358 . . . . 0.0 110.97 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 615' ' ' LEU . . . . . 0.469 HD13 ' CB ' ' A' ' 729' ' ' GLU . 1.6 mt -117.52 -176.3 2.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.855 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . 133.01 92.28 0.5 Allowed Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.564 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.2 120.71 11.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.027 0.442 . . . . 0.0 110.591 179.651 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.44 136.33 33.49 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.864 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 619' ' ' TRP . . . . . 0.507 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.1 OUTLIER -64.1 -15.61 60.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.443 -179.891 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 119.93 161.72 11.65 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.385 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -68.22 -36.19 17.16 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.499 2.133 . . . . 0.0 112.264 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 622' ' ' ASN . . . . . 0.48 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 43.1 m-80 -67.56 -35.86 79.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.856 179.904 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 623' ' ' VAL . . . . . 0.436 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 40.6 t -70.44 -38.48 74.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.618 179.527 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 624' ' ' GLN . . . . . 0.558 ' HG2' HD21 ' A' ' 722' ' ' LEU . 24.6 tp60 -68.17 -34.76 76.9 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.332 179.518 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 625' ' ' ARG . . . . . 0.517 ' O ' HD12 ' A' ' 629' ' ' ILE . 0.1 OUTLIER -63.21 -50.71 69.2 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.33 179.511 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 8.5 tt -67.35 -33.52 75.42 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.711 179.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . . . . . . . . . . . -69.09 -46.87 66.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.209 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -59.07 -49.18 78.88 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.073 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 629' ' ' ILE . . . . . 0.716 HG21 HD23 ' A' ' 653' ' ' LEU . 7.3 mt -62.97 -35.46 71.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.109 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 630' ' ' LYS . . . . . . . . . . . . . 5.7 ttpt -63.21 -47.85 80.81 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.069 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.31 -39.25 92.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.08 -179.896 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 632' ' ' HIS . . . . . 0.791 ' HB2' HD13 ' A' ' 717' ' ' LEU . 78.5 t60 -70.73 -42.58 70.37 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.161 -179.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.587 HD13 ' SD ' ' A' ' 640' ' ' MET . 15.4 mt -58.13 -50.07 74.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.349 -179.559 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.62 -42.36 98.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.796 0.331 . . . . 0.0 110.671 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -73.59 -11.5 60.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.066 179.457 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 636' ' ' GLN . . . . . 0.4 ' CG ' ' CE1' ' A' ' 632' ' ' HIS . 15.6 mm-40 -98.62 -9.32 24.93 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.573 -179.799 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 119.06 -9.04 12.28 Favored Glycine 0 C--N 1.331 0.303 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.467 179.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 638' ' ' ILE . . . . . 0.648 ' N ' HD12 ' A' ' 638' ' ' ILE . 3.5 mp -100.69 104.65 16.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 120.748 0.309 . . . . 0.0 111.112 -179.62 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 2.4 m -76.68 113.44 14.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.89 179.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 640' ' ' MET . . . . . 0.587 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.9 mtp -129.09 31.7 4.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.97 -179.862 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -62.55 -28.53 69.93 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.043 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 642' ' ' GLU . . . . . 0.475 ' O ' HD12 ' A' ' 643' ' ' LEU . 27.4 mt-10 -79.86 -80.13 0.13 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.041 -179.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 643' ' ' LEU . . . . . 0.475 HD12 ' O ' ' A' ' 642' ' ' GLU . 0.0 OUTLIER -177.54 140.14 0.43 Allowed Pre-proline 0 C--N 1.331 -0.223 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.876 -179.972 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 644' ' ' PRO . . . . . 0.46 ' HB2' HD11 ' A' ' 651' ' ' LEU . 72.4 Cg_endo -77.02 147.36 26.61 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.588 2.192 . . . . 0.0 112.481 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 645' ' ' LEU . . . . . 0.65 HD12 ' HA ' ' A' ' 650' ' ' GLU . 5.1 tp -136.04 150.51 49.21 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.131 0.491 . . . . 0.0 110.965 179.675 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 646' ' ' ILE . . . . . 0.767 HD11 ' HA ' ' A' ' 695' ' ' LEU . 0.6 OUTLIER -147.85 132.19 9.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.701 179.249 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 53.31 41.79 62.86 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.317 -0.944 . . . . 0.0 112.345 -179.367 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 69.52 7.49 58.09 Favored Glycine 0 C--N 1.332 0.348 0 C-N-CA 121.0 -0.619 . . . . 0.0 113.779 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 1.7 m -132.97 163.76 28.48 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 117.358 0.579 . . . . 0.0 111.434 -179.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 650' ' ' GLU . . . . . 0.65 ' HA ' HD12 ' A' ' 645' ' ' LEU . 1.1 mp0 -79.66 144.54 33.65 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.708 179.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 651' ' ' LEU . . . . . 0.603 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -135.11 144.93 47.4 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.125 0.488 . . . . 0.0 111.357 -179.661 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.9 107.26 19.29 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.856 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 653' ' ' LEU . . . . . 0.716 HD23 HG21 ' A' ' 629' ' ' ILE . 7.2 mp -55.03 -40.21 69.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.959 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 654' ' ' ALA . . . . . 0.48 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -59.19 -43.45 92.22 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.98 179.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 5.6 t -72.16 -43.03 65.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.613 179.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 656' ' ' PHE . . . . . 0.435 ' CE2' ' HG ' ' A' ' 682' ' ' LEU . 0.3 OUTLIER -60.45 -46.37 90.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.754 179.801 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -60.6 -49.5 77.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.936 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.1 -43.22 99.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.946 -179.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . 0.469 HD22 ' O ' ' A' ' 678' ' ' LEU . 0.2 OUTLIER -57.55 -39.85 77.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.161 -179.87 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 660' ' ' ILE . . . . . 0.746 HD11 ' CH2' ' A' ' 675' ' ' TRP . 83.1 mt -69.01 -43.71 81.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.785 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.35 -43.35 94.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.051 -179.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -69.81 -13.73 62.41 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.355 -179.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . . . . . . . . . 1.2 ttm -94.27 21.18 7.24 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.29 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 95.44 -2.77 65.45 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.61 -0.805 . . . . 0.0 113.124 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 116.06 178.47 18.26 Favored Glycine 0 C--N 1.332 0.314 0 C-N-CA 120.539 -0.839 . . . . 0.0 112.446 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 666' ' ' MET . . . . . 0.705 ' HG2' HG21 ' A' ' 660' ' ' ILE . 0.0 OUTLIER -71.55 -30.85 66.35 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.862 0.363 . . . . 0.0 110.911 179.896 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 667' ' ' GLN . . . . . 0.401 ' O ' ' CB ' ' A' ' 671' ' ' ASP . 19.0 pt20 -57.79 -48.74 78.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.458 -179.725 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 668' ' ' GLN . . . . . 0.415 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 8.9 mm-40 -62.37 -52.41 63.71 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.864 0.364 . . . . 0.0 111.334 -179.637 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 669' ' ' VAL . . . . . 0.613 HG21 HG23 ' A' ' 660' ' ' ILE . 73.4 t -51.4 -55.78 7.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.936 -179.646 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 670' ' ' THR . . . . . 0.526 HG22 ' O ' ' A' ' 666' ' ' MET . 8.0 t -76.09 -50.03 15.83 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 -178.099 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 671' ' ' ASP . . . . . 0.477 ' N ' HG23 ' A' ' 670' ' ' THR . 5.7 t70 -61.6 -51.15 69.72 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -177.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 672' ' ' LEU . . . . . 0.415 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 8.8 mp -78.59 2.7 18.42 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 -178.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 48.77 86.6 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.139 0 CA-C-O 120.994 0.426 . . . . 0.0 110.485 -179.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -149.15 21.75 0.96 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.077 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 675' ' ' TRP . . . . . 1.072 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 36.2 m95 -59.02 -27.98 65.98 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 121.447 0.641 . . . . 0.0 110.093 179.706 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -56.54 -42.79 79.11 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.542 -179.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -76.58 -51.62 11.28 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.784 0.326 . . . . 0.0 111.419 -179.535 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.972 HD22 ' HA ' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.49 -39.73 70.8 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 179.693 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 679' ' ' ALA . . . . . 0.845 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.94 -34.65 69.2 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.507 179.154 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -53.24 -48.5 68.16 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.433 179.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.14 -21.42 66.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.769 179.37 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 682' ' ' LEU . . . . . 0.541 HD23 ' O ' ' A' ' 678' ' ' LEU . 3.6 mm? -78.9 -1.41 35.0 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.496 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . 0.675 ' C ' HD12 ' A' ' 684' ' ' ILE . 3.5 mpt_? 68.5 71.81 0.29 Allowed 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.94 0.4 . . . . 0.0 111.489 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . 0.675 HD12 ' C ' ' A' ' 683' ' ' ARG . 1.9 mp -123.97 136.02 26.99 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.273 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . . . . . . . . . 29.1 Cg_endo -63.25 125.33 15.52 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 122.418 2.079 . . . . 0.0 112.414 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.77 -16.05 63.23 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.102 179.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -65.57 -23.95 66.97 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.216 -179.787 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 688' ' ' ALA . . . . . 0.471 ' HB1' ' HB3' ' A' ' 691' ' ' ARG . . . -77.84 115.68 17.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.859 0.361 . . . . 0.0 110.769 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -76.18 -68.24 0.6 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.376 -179.456 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 56.9 m-20 -57.76 -11.67 2.41 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -178.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 691' ' ' ARG . . . . . 0.484 ' CG ' HD22 ' A' ' 692' ' ' LEU . 4.9 ptt-85 -50.32 -32.44 17.12 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.791 0.329 . . . . 0.0 111.049 -179.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . 0.484 HD22 ' CG ' ' A' ' 691' ' ' ARG . 2.9 mm? -68.17 -50.39 54.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.925 -179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.03 -37.31 69.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.039 179.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 694' ' ' LYS . . . . . 0.408 ' O ' ' HB2' ' A' ' 698' ' ' ALA . 1.3 mtpt -63.28 -37.83 88.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.243 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 1.072 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.5 OUTLIER -68.77 -44.26 74.04 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.484 179.74 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.449 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 31.8 tt0 -55.37 -47.7 75.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.748 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 71.1 mt-10 -77.11 -29.61 54.91 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.834 179.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' A' ' 694' ' ' LYS . . . -66.46 -38.03 86.44 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.46 -179.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 699' ' ' TYR . . . . . 0.499 ' CD2' ' CZ2' ' A' ' 675' ' ' TRP . 1.0 OUTLIER -85.92 -30.53 22.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.893 0.378 . . . . 0.0 110.496 179.862 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 700' ' ' CYS . . . . . 0.467 ' HA ' HD23 ' A' ' 704' ' ' LEU . 15.4 t -66.84 -30.51 70.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.644 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 4.2 tt0 -99.49 -2.32 36.24 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.478 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 702' ' ' TYR . . . . . 0.405 ' CD1' ' O ' ' A' ' 698' ' ' ALA . 6.2 m-85 -117.68 -78.27 0.58 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.802 0.334 . . . . 0.0 111.214 -179.883 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 703' ' ' LEU . . . . . . . . . . . . . 75.7 mt -57.71 -43.74 85.44 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.464 -179.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.467 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.6 OUTLIER -55.08 -52.22 63.89 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.881 0.372 . . . . 0.0 111.008 -179.921 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . 0.601 ' O ' HD13 ' A' ' 709' ' ' LEU . 59.7 p -54.37 -55.0 32.98 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.665 179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 706' ' ' TYR . . . . . 0.442 ' HA ' ' CD2' ' A' ' 632' ' ' HIS . 9.7 t80 -46.9 -43.07 18.57 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.845 -179.571 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -94.03 0.02 55.72 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -179.48 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 22.6 t -79.19 -18.47 52.94 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -179.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 709' ' ' LEU . . . . . 0.601 HD13 ' O ' ' A' ' 705' ' ' SER . 0.0 OUTLIER -94.16 -173.92 3.23 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.831 0.348 . . . . 0.0 111.406 -179.815 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 710' ' ' SER . . . . . 0.407 ' CB ' ' HD2' ' A' ' 711' ' ' PRO . 0.3 OUTLIER -85.45 165.97 33.0 Favored Pre-proline 0 C--N 1.332 -0.181 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.048 -179.804 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . 0.407 ' HD2' ' CB ' ' A' ' 710' ' ' SER . 18.0 Cg_endo -57.89 -18.93 37.12 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.625 2.217 . . . . 0.0 112.734 -179.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -60.91 -54.27 47.06 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.913 0.387 . . . . 0.0 110.72 179.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 713' ' ' GLU . . . . . 0.419 ' HB2' ' HG ' ' A' ' 709' ' ' LEU . 18.6 mm-40 -60.41 -26.06 66.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.832 179.662 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 714' ' ' HIS . . . . . 0.437 ' CE1' ' CZ ' ' A' ' 706' ' ' TYR . 1.3 m-70 -75.61 -53.86 7.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.114 179.255 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 6.2 mmm180 -64.65 -33.02 74.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.07 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 3.3 mtt180 -67.47 -54.28 21.62 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.867 0.365 . . . . 0.0 110.805 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . 0.791 HD13 ' HB2' ' A' ' 632' ' ' HIS . 25.9 mt -64.12 -37.47 87.55 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.478 179.63 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . 0.575 ' HG3' HD23 ' A' ' 722' ' ' LEU . 25.5 tt0 -67.63 -53.92 23.94 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.357 179.605 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.3 -34.76 48.16 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.497 -179.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 720' ' ' GLU . . . . . 0.408 ' O ' ' HG2' ' A' ' 723' ' ' MET . 1.2 mm-40 -67.69 -55.85 11.62 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.06 0.457 . . . . 0.0 110.279 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 721' ' ' VAL . . . . . 0.507 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 44.2 t -60.78 -50.96 78.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.638 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . 0.575 HD23 ' HG3' ' A' ' 718' ' ' GLU . 2.2 mm? -48.79 -46.39 41.5 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.907 -179.354 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 723' ' ' MET . . . . . 0.578 ' O ' HD12 ' A' ' 727' ' ' ILE . 18.0 ptp -73.99 -40.77 62.72 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.098 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -50.76 -41.53 56.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.759 -179.199 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 725' ' ' LYS . . . . . 0.519 ' NZ ' HD13 ' A' ' 722' ' ' LEU . 0.0 OUTLIER -83.23 -40.2 19.93 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.65 0.262 . . . . 0.0 111.271 -179.687 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -60.56 -52.99 62.84 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.968 0.413 . . . . 0.0 110.836 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 727' ' ' ILE . . . . . 0.616 HG22 ' O ' ' A' ' 727' ' ' ILE . 4.2 mp -89.82 11.62 2.0 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.558 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 6.6 tt -53.87 -42.47 68.64 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 120.847 0.356 . . . . 0.0 111.152 -179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 729' ' ' GLU . . . . . 0.469 ' CB ' HD13 ' A' ' 615' ' ' LEU . 2.9 mt-10 -71.98 -70.64 0.32 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.962 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 730' ' ' LYS . . . . . 0.522 ' NZ ' HG23 ' A' ' 727' ' ' ILE . 0.7 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.23 -0.89 . . . . 0.0 110.96 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.177 0 N-CA-C 112.535 -0.226 . . . . 0.0 112.535 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -52.33 -35.22 63.67 Favored 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.566 2.177 . . . . 0.0 112.341 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.88 175.86 6.92 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.907 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . -155.23 96.18 0.16 Allowed Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.497 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.37 33.15 1.49 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.818 0.342 . . . . 0.0 110.881 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 26.6 mt -68.97 156.79 37.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.924 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . 0.417 ' O ' ' HD2' ' A' ' 617' ' ' ARG . . . -110.94 -61.27 0.48 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.529 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . 0.422 ' HD2' ' HA ' ' A' ' 617' ' ' ARG . 24.5 mmm180 -156.85 124.56 5.44 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.935 0.398 . . . . 0.0 110.888 179.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.05 127.48 14.98 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.876 179.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 619' ' ' TRP . . . . . 0.572 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.1 OUTLIER -64.66 -14.85 60.04 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.439 -179.948 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 118.53 161.32 11.78 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.373 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -67.47 -39.81 11.76 Favored 'Trans proline' 0 C--N 1.344 0.301 0 C-N-CA 122.497 2.131 . . . . 0.0 112.332 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 622' ' ' ASN . . . . . 0.474 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 11.6 p30 -65.08 -35.97 82.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.941 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 623' ' ' VAL . . . . . 0.429 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 42.1 t -67.81 -43.62 86.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.751 179.686 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 624' ' ' GLN . . . . . 0.524 ' HG2' HD11 ' A' ' 722' ' ' LEU . 40.9 tp60 -59.49 -42.68 92.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.526 179.686 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -58.66 -50.75 72.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.429 179.596 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 626' ' ' LEU . . . . . 0.485 ' O ' HD23 ' A' ' 626' ' ' LEU . 6.6 tt -65.7 -28.31 68.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.79 179.611 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . 0.411 ' HA ' ' HG2' ' A' ' 630' ' ' LYS . . . -71.4 -52.56 17.89 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.587 -179.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 29.5 p -60.84 -38.63 86.18 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.396 -179.533 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 629' ' ' ILE . . . . . 0.636 HG21 HD23 ' A' ' 653' ' ' LEU . 51.3 mt -66.72 -45.54 87.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.329 -179.728 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 630' ' ' LYS . . . . . 0.411 ' HG2' ' HA ' ' A' ' 627' ' ' ALA . 43.8 pttt -66.24 -33.89 76.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.722 0.296 . . . . 0.0 110.987 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 2.0 tttm -67.35 -46.8 72.34 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.014 0.435 . . . . 0.0 110.79 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 632' ' ' HIS . . . . . 0.704 ' HB2' HD13 ' A' ' 717' ' ' LEU . 86.6 t60 -67.28 -39.61 86.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.734 179.77 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.626 HD23 HD13 ' A' ' 638' ' ' ILE . 21.8 mt -57.82 -48.99 78.17 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.047 -179.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 634' ' ' ARG . . . . . 0.421 ' HG3' ' N ' ' A' ' 635' ' ' SER . 0.1 OUTLIER -63.16 -40.6 98.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.831 179.974 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 635' ' ' SER . . . . . 0.421 ' N ' ' HG3' ' A' ' 634' ' ' ARG . 1.6 m -73.68 -19.93 60.69 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.219 179.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 5.3 tp-100 -90.58 -7.45 52.79 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.677 -179.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 117.92 -13.12 12.98 Favored Glycine 0 C--N 1.331 0.301 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.478 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 638' ' ' ILE . . . . . 0.626 HD13 HD23 ' A' ' 633' ' ' LEU . 2.8 mp -94.38 104.59 15.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 120.608 0.242 . . . . 0.0 111.219 -179.716 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -77.56 121.34 23.77 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.837 0.351 . . . . 0.0 111.007 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 640' ' ' MET . . . . . 0.413 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.9 ttp -133.02 30.19 4.0 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.882 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -65.56 -33.99 77.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.872 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -69.59 -77.39 0.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.846 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 643' ' ' LEU . . . . . 0.445 ' O ' HD12 ' A' ' 643' ' ' LEU . 1.4 pp -179.98 136.68 0.28 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.873 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 644' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.81 121.01 7.0 Favored 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.499 2.132 . . . . 0.0 112.168 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 645' ' ' LEU . . . . . 0.633 HD12 ' HA ' ' A' ' 650' ' ' GLU . 5.0 tp -119.88 149.52 41.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.221 0.534 . . . . 0.0 111.287 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 646' ' ' ILE . . . . . 0.531 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.2 tt -144.83 130.15 14.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.45 178.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . 0.408 ' O ' ' NH1' ' A' ' 691' ' ' ARG . . . 51.91 47.0 54.82 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.269 -0.967 . . . . 0.0 112.086 -179.157 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 64.79 7.67 30.2 Favored Glycine 0 CA--C 1.521 0.421 0 C-N-CA 121.034 -0.603 . . . . 0.0 113.899 179.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 98.7 m -129.73 161.7 30.08 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 117.592 0.696 . . . . 0.0 111.516 -179.21 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 650' ' ' GLU . . . . . 0.633 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.8 OUTLIER -81.19 142.55 33.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.638 179.659 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 651' ' ' LEU . . . . . 0.62 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.9 144.72 47.66 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.041 0.448 . . . . 0.0 111.309 -179.737 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -94.16 109.18 20.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.782 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 653' ' ' LEU . . . . . 0.636 HD23 HG21 ' A' ' 629' ' ' ILE . 6.3 mp -56.67 -35.41 68.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.867 -180.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 654' ' ' ALA . . . . . 0.474 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -65.09 -46.81 79.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.958 179.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 46.9 t -70.58 -32.66 70.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.562 179.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 656' ' ' PHE . . . . . 0.484 ' O ' HG13 ' A' ' 660' ' ' ILE . 0.2 OUTLIER -70.55 -46.07 64.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.81 179.881 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -60.14 -49.98 75.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.933 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 658' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 658' ' ' ARG . 0.9 OUTLIER -58.23 -43.99 88.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.963 -179.954 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.49 -48.01 80.38 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.253 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 660' ' ' ILE . . . . . 0.712 HG21 ' HG2' ' A' ' 666' ' ' MET . 23.3 mt -56.85 -45.73 83.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.916 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -64.68 -47.19 79.34 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.029 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -62.38 -16.75 56.51 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.441 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . 0.413 ' CE ' ' HB3' ' A' ' 678' ' ' LEU . 0.1 OUTLIER -94.25 31.86 1.63 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.67 0.272 . . . . 0.0 111.295 -179.826 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 76.15 42.37 24.24 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.824 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 665' ' ' GLY . . . . . . . . . . . . . . . 78.21 172.76 40.55 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.707 179.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 666' ' ' MET . . . . . 0.712 ' HG2' HG21 ' A' ' 660' ' ' ILE . 0.0 OUTLIER -73.13 -33.66 65.66 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.769 0.319 . . . . 0.0 111.322 179.963 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 16.0 pt20 -53.05 -43.76 66.9 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.322 -179.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 668' ' ' GLN . . . . . 0.452 ' O ' ' HB2' ' A' ' 672' ' ' LEU . 0.0 OUTLIER -64.66 -52.48 57.09 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.972 0.415 . . . . 0.0 110.707 -179.968 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 669' ' ' VAL . . . . . 0.63 HG21 HG23 ' A' ' 660' ' ' ILE . 90.6 t -49.28 -55.52 4.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.567 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 670' ' ' THR . . . . . 0.56 HG22 ' O ' ' A' ' 666' ' ' MET . 8.8 t -76.19 -51.47 12.05 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -178.467 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 671' ' ' ASP . . . . . 0.492 ' N ' HG23 ' A' ' 670' ' ' THR . 4.8 t70 -63.72 -51.3 65.59 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 -177.658 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 672' ' ' LEU . . . . . 0.452 ' HB2' ' O ' ' A' ' 668' ' ' GLN . 9.3 mp -77.3 3.34 13.23 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -179.039 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 49.02 86.35 0.03 OUTLIER 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.966 0.412 . . . . 0.0 110.509 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 21.0 mttt -146.2 21.91 1.37 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.261 -179.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 675' ' ' TRP . . . . . 1.107 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 42.5 m95 -60.91 -28.57 69.02 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 121.401 0.619 . . . . 0.0 110.167 179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 676' ' ' ASN . . . . . 0.637 ' CG ' HD11 ' A' ' 692' ' ' LEU . 49.4 m-80 -55.76 -43.84 77.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.534 -179.69 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 2.7 ttmm -77.09 -51.53 10.88 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-O 120.769 0.318 . . . . 0.0 111.4 -179.49 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.976 HD22 ' HA ' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -54.92 -41.25 70.75 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 179.65 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 679' ' ' ALA . . . . . 0.826 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.78 -34.51 69.48 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.766 179.283 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -53.17 -47.67 68.61 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.394 179.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 20.1 mtm -64.67 -21.57 66.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.764 179.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 682' ' ' LEU . . . . . 0.5 ' O ' ' HB2' ' A' ' 683' ' ' ARG . 3.2 mm? -80.11 -2.08 42.94 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.464 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . 0.815 ' C ' HD12 ' A' ' 684' ' ' ILE . 0.2 OUTLIER 72.34 71.76 0.15 Allowed 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.925 0.393 . . . . 0.0 111.7 179.81 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . 0.815 HD12 ' C ' ' A' ' 683' ' ' ARG . 2.1 mp -129.22 139.95 37.2 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.062 179.406 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . 0.579 ' HD2' HG23 ' A' ' 684' ' ' ILE . 41.0 Cg_endo -66.83 124.81 12.79 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.303 2.002 . . . . 0.0 112.381 -179.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -19.18 63.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.19 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -65.34 -18.81 65.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.384 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 688' ' ' ALA . . . . . 0.43 ' CB ' ' NE ' ' A' ' 691' ' ' ARG . . . -84.47 107.08 16.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.863 0.363 . . . . 0.0 111.056 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -70.82 -67.77 0.48 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.06 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 45.1 m-20 -48.96 -20.93 0.57 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.972 -179.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 691' ' ' ARG . . . . . 0.43 ' NE ' ' CB ' ' A' ' 688' ' ' ALA . 1.4 ttm180 -46.37 -40.35 11.83 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.803 0.335 . . . . 0.0 111.297 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . 0.637 HD11 ' CG ' ' A' ' 676' ' ' ASN . 4.5 mm? -63.15 -46.46 87.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.183 -179.758 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -72.15 -38.67 69.13 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.774 0.321 . . . . 0.0 111.233 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 16.4 mmtt -63.54 -42.19 98.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.989 0.424 . . . . 0.0 110.339 179.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 1.107 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 0.2 OUTLIER -66.84 -40.67 88.04 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.404 179.646 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.425 ' O ' ' CD2' ' A' ' 699' ' ' TYR . 8.9 mt-30 -57.74 -44.98 86.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.788 179.733 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -77.31 -29.81 53.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.203 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . 0.4 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.28 -38.36 84.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.653 -179.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 699' ' ' TYR . . . . . 0.576 ' HB2' HD12 ' A' ' 703' ' ' LEU . 1.8 p90 -83.65 -37.23 23.1 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.864 0.364 . . . . 0.0 110.484 179.875 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 700' ' ' CYS . . . . . 0.562 ' HA ' HD23 ' A' ' 704' ' ' LEU . 6.8 t -62.18 -30.64 71.21 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.553 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -95.83 -3.49 45.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.32 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 702' ' ' TYR . . . . . 0.4 ' CD1' ' O ' ' A' ' 698' ' ' ALA . 10.1 m-85 -118.46 -78.53 0.58 Allowed 'General case' 0 CA--C 1.529 0.14 0 CA-C-O 120.849 0.356 . . . . 0.0 111.59 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 703' ' ' LEU . . . . . 0.576 HD12 ' HB2' ' A' ' 699' ' ' TYR . 23.2 mt -60.22 -43.85 95.68 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.966 -179.069 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.562 HD23 ' HA ' ' A' ' 700' ' ' CYS . 0.4 OUTLIER -47.9 -56.65 7.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.82 0.343 . . . . 0.0 111.647 -179.442 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 42.3 p -54.4 -48.57 71.43 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.405 -179.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 706' ' ' TYR . . . . . 0.596 ' O ' HD22 ' A' ' 709' ' ' LEU . 57.3 t80 -65.51 -29.21 69.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.529 -179.591 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -96.95 0.64 49.24 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -179.438 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 708' ' ' SER . . . . . . . . . . . . . 39.8 t -115.54 -12.77 11.6 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 111.771 0.285 . . . . 0.0 111.771 -179.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 709' ' ' LEU . . . . . 0.596 HD22 ' O ' ' A' ' 706' ' ' TYR . 0.3 OUTLIER -79.71 179.46 7.51 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.743 0.306 . . . . 0.0 111.04 -179.969 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -75.04 164.45 61.28 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.143 -179.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -68.87 -25.94 32.41 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.645 2.23 . . . . 0.0 112.203 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -50.55 -49.83 55.04 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.748 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 713' ' ' GLU . . . . . 0.585 ' HB2' HD11 ' A' ' 709' ' ' LEU . 1.5 mm-40 -59.89 -27.24 66.54 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.024 179.848 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 714' ' ' HIS . . . . . 0.555 ' CD2' HD21 ' A' ' 709' ' ' LEU . 12.8 m170 -76.14 -54.03 7.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.501 179.484 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.16 -44.25 97.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.437 -179.614 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 20.8 mtp85 -66.19 -54.18 28.37 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.223 -179.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . 0.704 HD13 ' HB2' ' A' ' 632' ' ' HIS . 53.1 mt -62.64 -39.54 94.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.674 179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -67.33 -54.03 24.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.33 179.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -50.53 -34.7 26.39 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.337 -179.791 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 720' ' ' GLU . . . . . 0.429 ' O ' ' HG2' ' A' ' 723' ' ' MET . 0.5 OUTLIER -69.39 -55.43 10.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.005 0.431 . . . . 0.0 110.561 179.626 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 721' ' ' VAL . . . . . 0.634 HG23 ' O ' ' A' ' 717' ' ' LEU . 16.8 t -62.03 -54.94 27.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.156 -179.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . 0.524 HD11 ' HG2' ' A' ' 624' ' ' GLN . 1.2 mp -50.51 -44.18 56.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.754 -0.657 . . . . 0.0 112.009 -179.266 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 723' ' ' MET . . . . . 0.622 ' O ' HD12 ' A' ' 727' ' ' ILE . 16.9 ptp -71.44 -40.31 70.47 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 120.496 -0.481 . . . . 0.0 110.024 179.719 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 724' ' ' GLU . . . . . 0.4 ' N ' ' HG3' ' A' ' 723' ' ' MET . 5.6 mm-40 -57.49 -31.58 66.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.381 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 725' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.14 -43.14 13.28 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.404 -179.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -66.52 -48.93 68.19 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.834 0.349 . . . . 0.0 111.193 -179.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 727' ' ' ILE . . . . . 0.631 HG22 ' O ' ' A' ' 727' ' ' ILE . 3.9 mp -88.96 11.67 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.534 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 5.6 tt -57.38 -36.41 71.21 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.789 0.328 . . . . 0.0 111.028 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -64.57 -68.65 0.34 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.934 -179.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.895 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 610' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.231 0 N-CA-C 112.428 -0.269 . . . . 0.0 112.428 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 611' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -71.23 -37.36 5.98 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.572 2.181 . . . . 0.0 112.303 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -80.9 -178.95 7.08 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.909 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 613' ' ' GLY . . . . . . . . . . . . . . . -159.86 -93.74 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.484 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 614' ' ' SER . . . . . . . . . . . . . 24.4 t -171.48 35.76 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.827 0.346 . . . . 0.0 110.922 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 615' ' ' LEU . . . . . . . . . . . . . 16.4 mt -83.21 158.81 22.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.908 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 616' ' ' GLY . . . . . . . . . . . . . . . -141.54 56.02 0.6 Allowed Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.462 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 617' ' ' ARG . . . . . . . . . . . . . 3.5 mtp180 -99.41 -1.96 37.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.198 0.523 . . . . 0.0 111.564 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 618' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -144.49 156.09 44.02 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.986 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 619' ' ' TRP . . . . . 0.541 ' HZ2' HG12 ' A' ' 721' ' ' VAL . 0.0 OUTLIER -83.28 -17.85 41.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.258 179.913 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 620' ' ' GLY . . . . . . . . . . . . . . . 123.44 163.25 11.71 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.443 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 621' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -66.75 -39.11 15.93 Favored 'Trans proline' 0 C--N 1.343 0.287 0 C-N-CA 122.542 2.162 . . . . 0.0 112.118 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 622' ' ' ASN . . . . . 0.668 ' O ' ' HB2' ' A' ' 654' ' ' ALA . 6.0 p30 -63.15 -39.25 94.13 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.888 179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 623' ' ' VAL . . . . . 0.465 ' HB ' ' CD1' ' A' ' 619' ' ' TRP . 38.8 t -73.29 -35.32 46.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.781 179.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 624' ' ' GLN . . . . . 0.656 ' CG ' HD11 ' A' ' 722' ' ' LEU . 2.2 tm0? -60.2 -42.43 95.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.689 179.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 625' ' ' ARG . . . . . . . . . . . . . 4.8 tpp180 -69.32 -48.54 61.17 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.72 179.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 626' ' ' LEU . . . . . . . . . . . . . 8.1 tt -61.45 -30.74 70.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.828 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 627' ' ' ALA . . . . . 0.479 ' HB1' HG11 ' A' ' 721' ' ' VAL . . . -72.02 -50.63 26.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.201 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 628' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -57.2 -46.94 82.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.999 -179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 629' ' ' ILE . . . . . 0.655 HG21 HD23 ' A' ' 653' ' ' LEU . 12.6 mt -64.47 -39.2 84.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.91 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 630' ' ' LYS . . . . . 0.487 ' HA ' HD12 ' A' ' 633' ' ' LEU . 10.6 ttpt -60.77 -49.73 76.33 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.738 179.89 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 631' ' ' LYS . . . . . . . . . . . . . 9.5 tttm -59.5 -38.17 80.21 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.75 179.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 632' ' ' HIS . . . . . 0.449 ' CE1' ' CD1' ' A' ' 709' ' ' LEU . 81.8 t60 -70.08 -44.25 69.47 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.83 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 633' ' ' LEU . . . . . 0.662 HD13 ' SD ' ' A' ' 640' ' ' MET . 10.6 mt -55.89 -50.2 71.3 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.369 -179.552 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 634' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.92 -41.8 97.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.765 0.317 . . . . 0.0 110.75 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 635' ' ' SER . . . . . . . . . . . . . 6.7 t -73.5 -11.5 60.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.958 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 636' ' ' GLN . . . . . . . . . . . . . 35.5 mm-40 -99.04 -10.59 22.41 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.551 -179.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 637' ' ' GLY . . . . . . . . . . . . . . . 117.12 -0.83 19.31 Favored Glycine 0 C--N 1.332 0.34 0 C-N-CA 120.581 -0.819 . . . . 0.0 112.623 179.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 638' ' ' ILE . . . . . 0.415 HG21 ' CE2' ' A' ' 702' ' ' TYR . 13.8 mt -108.44 109.94 30.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 120.712 0.292 . . . . 0.0 111.327 -179.47 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 639' ' ' THR . . . . . . . . . . . . . 5.1 m -83.81 115.06 22.05 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.861 179.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 640' ' ' MET . . . . . 0.662 ' SD ' HD13 ' A' ' 633' ' ' LEU . 1.6 mtp -125.38 30.73 5.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.964 -179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 641' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -64.02 -30.76 71.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.956 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 642' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -74.51 -80.09 0.08 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.957 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 643' ' ' LEU . . . . . 0.417 HD12 ' HA ' ' A' ' 643' ' ' LEU . 8.7 tp -179.08 132.09 0.27 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.845 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 644' ' ' PRO . . . . . 0.54 ' HB2' HD11 ' A' ' 651' ' ' LEU . 66.2 Cg_endo -74.49 137.86 23.55 Favored 'Trans proline' 0 C--N 1.345 0.39 0 C-N-CA 122.481 2.121 . . . . 0.0 112.279 179.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 645' ' ' LEU . . . . . 0.636 HD12 ' HA ' ' A' ' 650' ' ' GLU . 4.8 tp -129.19 151.6 49.69 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.187 0.518 . . . . 0.0 111.236 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 646' ' ' ILE . . . . . 0.665 HD11 ' HA ' ' A' ' 695' ' ' LEU . 1.3 tt -149.64 133.51 8.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.873 179.086 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 647' ' ' GLY . . . . . . . . . . . . . . . 54.64 38.35 63.46 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.342 -0.933 . . . . 0.0 112.221 -179.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 648' ' ' GLY . . . . . . . . . . . . . . . 71.05 7.92 63.59 Favored Glycine 0 C--N 1.333 0.377 0 C-N-CA 120.924 -0.655 . . . . 0.0 113.595 179.353 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 649' ' ' CYS . . . . . . . . . . . . . 2.1 m -133.73 163.89 28.45 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 117.315 0.557 . . . . 0.0 111.424 -179.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 650' ' ' GLU . . . . . 0.636 ' HA ' HD12 ' A' ' 645' ' ' LEU . 0.3 OUTLIER -78.28 145.52 35.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.669 179.679 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 651' ' ' LEU . . . . . 0.609 HD22 ' C ' ' A' ' 651' ' ' LEU . 0.0 OUTLIER -134.79 145.0 47.97 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.085 0.469 . . . . 0.0 111.466 -179.615 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 652' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -96.85 109.25 21.98 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.725 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 653' ' ' LEU . . . . . 0.655 HD23 HG21 ' A' ' 629' ' ' ILE . 8.2 mp -53.85 -35.29 61.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.949 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 654' ' ' ALA . . . . . 0.668 ' HB2' ' O ' ' A' ' 622' ' ' ASN . . . -65.02 -43.57 92.01 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.007 179.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 655' ' ' CYS . . . . . . . . . . . . . 49.6 t -72.87 -33.6 66.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.655 179.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 656' ' ' PHE . . . . . 0.44 ' CE2' ' HG ' ' A' ' 682' ' ' LEU . 0.3 OUTLIER -71.47 -47.92 52.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.805 179.891 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 657' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -59.45 -49.16 78.86 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.893 179.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 658' ' ' ARG . . . . . . . . . . . . . 22.2 tpp180 -59.66 -41.93 91.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.868 -180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 659' ' ' LEU . . . . . 0.752 HD22 ' CD2' ' A' ' 682' ' ' LEU . 0.1 OUTLIER -58.5 -49.18 78.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.103 -179.825 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 660' ' ' ILE . . . . . 0.685 HG23 HG21 ' A' ' 669' ' ' VAL . 27.9 mt -56.79 -45.66 83.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-O 120.791 0.329 . . . . 0.0 110.819 179.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 661' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -62.73 -42.31 99.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.884 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 662' ' ' GLU . . . . . . . . . . . . . 56.3 tt0 -72.11 -11.02 60.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.307 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 663' ' ' MET . . . . . 0.525 ' HE1' ' HB3' ' A' ' 678' ' ' LEU . 0.6 OUTLIER -96.49 32.3 2.05 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.806 0.336 . . . . 0.0 111.047 -179.876 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 664' ' ' GLY . . . . . . . . . . . . . . . 75.06 36.55 45.93 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.602 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 665' ' ' GLY . . . . . 0.426 ' O ' HG23 ' A' ' 669' ' ' VAL . . . 82.49 171.23 46.46 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.667 -0.778 . . . . 0.0 112.53 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 666' ' ' MET . . . . . 0.707 ' O ' HG22 ' A' ' 670' ' ' THR . 0.0 OUTLIER -72.49 -32.82 66.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.839 0.352 . . . . 0.0 111.035 179.962 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 667' ' ' GLN . . . . . . . . . . . . . 27.5 tt0 -54.13 -48.88 70.32 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.193 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 668' ' ' GLN . . . . . 0.447 ' HG3' HD13 ' A' ' 672' ' ' LEU . 0.0 OUTLIER -63.5 -50.63 68.88 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.827 0.346 . . . . 0.0 111.321 -179.632 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 669' ' ' VAL . . . . . 0.685 HG21 HG23 ' A' ' 660' ' ' ILE . 57.2 t -49.04 -52.66 9.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.917 0.389 . . . . 0.0 111.159 179.881 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 670' ' ' THR . . . . . 0.707 HG22 ' O ' ' A' ' 666' ' ' MET . 7.6 t -76.3 -53.92 7.51 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -178.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 671' ' ' ASP . . . . . 0.468 ' N ' HG23 ' A' ' 670' ' ' THR . 23.6 m-20 -60.2 -51.41 69.68 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.94 0.719 . . . . 0.0 112.94 -177.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 672' ' ' LEU . . . . . 0.447 HD13 ' HG3' ' A' ' 668' ' ' GLN . 6.9 mp -75.96 1.66 14.69 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.097 0.406 . . . . 0.0 112.097 -178.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 673' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 49.54 82.17 0.05 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.999 0.428 . . . . 0.0 110.297 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 674' ' ' LYS . . . . . . . . . . . . . 11.1 ttpt -142.19 23.4 2.02 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.272 -179.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 675' ' ' TRP . . . . . 1.1 ' CZ3' HD11 ' A' ' 695' ' ' LEU . 38.5 m95 -62.49 -28.54 69.9 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 121.361 0.6 . . . . 0.0 110.21 179.809 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 676' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -56.69 -44.41 81.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.49 -179.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 677' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.11 -51.51 12.07 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 120.814 0.34 . . . . 0.0 111.267 -179.602 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 678' ' ' LEU . . . . . 0.98 HD22 ' HA ' ' A' ' 675' ' ' TRP . 0.0 OUTLIER -55.21 -40.44 70.79 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 179.523 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 679' ' ' ALA . . . . . 0.839 ' N ' HD23 ' A' ' 678' ' ' LEU . . . -71.64 -33.9 69.32 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.59 179.188 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 680' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -53.54 -48.73 68.81 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.484 179.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 681' ' ' MET . . . . . . . . . . . . . 2.4 mtm -64.12 -20.02 65.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.968 179.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 682' ' ' LEU . . . . . 0.752 ' CD2' HD22 ' A' ' 659' ' ' LEU . 3.7 mm? -81.85 -0.98 45.98 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.513 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 683' ' ' ARG . . . . . 0.647 ' C ' HD12 ' A' ' 684' ' ' ILE . 5.1 mmm180 66.84 71.88 0.37 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.895 0.379 . . . . 0.0 111.603 179.729 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 684' ' ' ILE . . . . . 0.647 HD12 ' C ' ' A' ' 683' ' ' ARG . 2.1 mp -123.24 139.06 30.97 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.368 179.52 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 685' ' ' PRO . . . . . 0.507 ' HD2' HG23 ' A' ' 684' ' ' ILE . 33.0 Cg_endo -64.79 123.61 11.92 Favored 'Trans proline' 0 C--N 1.347 0.47 0 C-N-CA 122.422 2.082 . . . . 0.0 112.454 -179.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 686' ' ' LYS . . . . . . . . . . . . . 4.1 mmmt -69.92 -20.47 63.35 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.212 179.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 687' ' ' THR . . . . . . . . . . . . . 19.1 p -65.52 -23.86 66.98 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.555 -179.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 688' ' ' ALA . . . . . 0.458 ' HB3' ' HB3' ' A' ' 691' ' ' ARG . . . -69.14 110.77 4.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.756 0.312 . . . . 0.0 111.323 -179.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 689' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -83.38 4.68 26.4 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.527 179.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 690' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -119.33 -17.79 8.74 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.904 0.383 . . . . 0.0 110.674 179.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 691' ' ' ARG . . . . . 0.641 ' CG ' HD22 ' A' ' 692' ' ' LEU . 8.3 ptt85 -49.81 -36.47 26.61 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.542 -179.715 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 692' ' ' LEU . . . . . 0.641 HD22 ' CG ' ' A' ' 691' ' ' ARG . 2.6 mm? -68.77 -52.64 28.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.623 -179.25 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 693' ' ' ALA . . . . . . . . . . . . . . . -71.99 -39.65 69.1 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.838 0.352 . . . . 0.0 111.288 -179.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 694' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -61.86 -40.0 93.83 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.094 0.473 . . . . 0.0 110.15 179.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 695' ' ' LEU . . . . . 1.1 HD11 ' CZ3' ' A' ' 675' ' ' TRP . 2.7 tp -65.57 -45.34 83.67 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.53 179.57 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 696' ' ' GLN . . . . . 0.464 ' HA ' ' CE2' ' A' ' 699' ' ' TYR . 9.8 mt-30 -55.43 -50.85 68.74 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.05 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 697' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -74.14 -29.67 61.92 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.01 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 698' ' ' ALA . . . . . 0.416 ' O ' ' CD1' ' A' ' 702' ' ' TYR . . . -67.89 -39.29 83.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.602 -179.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 699' ' ' TYR . . . . . 0.517 ' CD2' ' CZ2' ' A' ' 675' ' ' TRP . 0.7 OUTLIER -86.0 -31.25 22.14 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.032 0.444 . . . . 0.0 110.485 179.84 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 700' ' ' CYS . . . . . 0.442 ' O ' ' HB2' ' A' ' 704' ' ' LEU . 43.8 t -66.92 -30.52 70.69 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.852 179.89 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 701' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.14 -1.16 37.39 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.567 -179.719 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 702' ' ' TYR . . . . . 0.455 ' CD2' ' CD2' ' A' ' 633' ' ' LEU . 5.8 m-85 -119.06 -79.08 0.59 Allowed 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.821 0.343 . . . . 0.0 111.326 -179.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 703' ' ' LEU . . . . . 0.627 ' CD2' HD12 ' A' ' 660' ' ' ILE . 3.8 tp -56.44 -43.06 79.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.571 -179.395 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 704' ' ' LEU . . . . . 0.442 ' HB2' ' O ' ' A' ' 700' ' ' CYS . 1.1 mm? -53.01 -37.17 61.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.893 0.378 . . . . 0.0 111.164 -179.771 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 705' ' ' SER . . . . . . . . . . . . . 3.9 m -65.63 -54.94 20.68 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.796 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 706' ' ' TYR . . . . . 0.625 ' O ' HD22 ' A' ' 709' ' ' LEU . 21.0 t80 -60.35 -29.19 68.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.738 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 707' ' ' ASP . . . . . . . . . . . . . 4.8 p30 -96.91 -7.21 33.88 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.159 0.429 . . . . 0.0 112.159 -179.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 708' ' ' SER . . . . . 0.402 ' CB ' ' O ' ' A' ' 704' ' ' LEU . 41.8 m -102.89 -22.55 13.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.708 0.29 . . . . 0.0 111.363 -179.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 709' ' ' LEU . . . . . 0.658 ' O ' HD23 ' A' ' 709' ' ' LEU . 0.2 OUTLIER -71.43 170.97 12.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.772 0.32 . . . . 0.0 111.005 -179.941 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 710' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.63 166.75 41.38 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.168 -179.687 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 711' ' ' PRO . . . . . 0.421 ' O ' ' HB2' ' A' ' 714' ' ' HIS . 38.0 Cg_endo -66.53 -32.03 40.25 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.57 2.18 . . . . 0.0 112.045 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 712' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -48.86 -48.69 41.77 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.578 179.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 713' ' ' GLU . . . . . 0.437 ' HB2' ' CD1' ' A' ' 709' ' ' LEU . 6.2 mm-40 -59.71 -26.2 65.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.111 179.633 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 714' ' ' HIS . . . . . 0.637 ' HD2' HD21 ' A' ' 709' ' ' LEU . 1.6 m-70 -75.87 -54.05 7.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.387 179.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 715' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.77 -42.43 99.68 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.282 -179.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 716' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -66.37 -54.25 26.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.821 0.343 . . . . 0.0 111.16 -179.598 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 717' ' ' LEU . . . . . 0.539 ' O ' HG23 ' A' ' 721' ' ' VAL . 73.4 mt -63.64 -39.91 95.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.723 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 718' ' ' GLU . . . . . 0.605 ' HG3' HD13 ' A' ' 722' ' ' LEU . 23.4 tt0 -67.52 -54.32 21.01 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.302 179.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 719' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -50.72 -34.94 28.92 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.358 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 720' ' ' GLU . . . . . 0.434 ' O ' ' HG2' ' A' ' 723' ' ' MET . 2.9 mm-40 -70.51 -55.42 8.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.996 0.427 . . . . 0.0 110.723 179.842 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 721' ' ' VAL . . . . . 0.541 HG12 ' HZ2' ' A' ' 619' ' ' TRP . 38.6 t -62.48 -54.87 28.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.112 -179.662 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 722' ' ' LEU . . . . . 0.656 HD11 ' CG ' ' A' ' 624' ' ' GLN . 3.6 mp -53.57 -40.04 65.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.872 -179.378 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 723' ' ' MET . . . . . 0.672 ' O ' HD12 ' A' ' 727' ' ' ILE . 9.5 ptp -74.59 -41.21 60.88 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 120.407 -0.517 . . . . 0.0 109.949 179.475 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 724' ' ' GLU . . . . . 0.409 ' N ' ' HG3' ' A' ' 723' ' ' MET . 4.2 mm-40 -55.61 -42.74 75.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.835 -179.414 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 725' ' ' LYS . . . . . 0.43 ' HB3' ' CZ3' ' A' ' 619' ' ' TRP . 0.0 OUTLIER -79.12 -36.66 40.27 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.661 -179.29 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -69.39 -53.27 20.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.837 0.351 . . . . 0.0 111.044 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 727' ' ' ILE . . . . . 0.672 HD12 ' O ' ' A' ' 723' ' ' MET . 3.7 mp -88.51 11.65 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.621 179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 728' ' ' LEU . . . . . . . . . . . . . 1.9 tt -53.98 -47.4 71.42 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.798 0.332 . . . . 0.0 111.121 -179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 729' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -73.21 -53.45 10.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.949 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 730' ' ' LYS . . . . . . . . . . . . . 24.3 mtmt . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.896 179.968 . . . . . . . . 0 0 . 1 stop_ save_